data_17532 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 17532 _Entry.Title ; NMR structure of Ca2+-bound CaBP1 C-domain with RDC ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2011-03-16 _Entry.Accession_date 2011-03-16 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 James Ames . . . 17532 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID 1 'not applicable' 'not applicable' . 17532 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'Ca2+-bound C-domain' . 17532 CaBP1 . 17532 calmodulin . 17532 EF-hand . 17532 NMR . 17532 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 17532 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 484 17532 '15N chemical shifts' 139 17532 '1H chemical shifts' 731 17532 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 3 . . 2013-01-28 2011-03-16 update BMRB 'update entry citation' 17532 2 . . 2011-06-24 2011-03-16 update BMRB 'update entry citation' 17532 1 . . 2011-06-07 2011-03-16 original author 'original release' 17532 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2LAP 'BMRB Entry Tracking System' 17532 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 17532 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 21608059 _Citation.Full_citation . _Citation.Title 'Nuclear magnetic resonance structure of calcium-binding protein 1 in a Ca(2+) -bound closed state: implications for target recognition.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Protein Sci.' _Citation.Journal_name_full 'Protein science : a publication of the Protein Society' _Citation.Journal_volume 20 _Citation.Journal_issue 8 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 1356 _Citation.Page_last 1366 _Citation.Year 2011 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Saebomi Park . . . 17532 1 2 Congmin Li . . . 17532 1 3 James Ames . B. . 17532 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 17532 _Assembly.ID 1 _Assembly.Name CaBP1 _Assembly.BMRB_code . _Assembly.Number_of_components 2 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass 16700 _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 CaBP1 1 $CaBP1 A . yes native no no . . . 17532 1 2 CA 2 $CA B . no native no no . . . 17532 1 stop_ loop_ _Assembly_bio_function.Biological_function _Assembly_bio_function.Entry_ID _Assembly_bio_function.Assembly_ID 'calcium sensor' 17532 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_CaBP1 _Entity.Sf_category entity _Entity.Sf_framecode CaBP1 _Entity.Entry_ID 17532 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name CaBP1 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MGNCVKYPLRNLSRKDRSLR PEEIEELREAFREFDKDKDG YINCRDLGNCMRTMGYMPTE MELIELSQQINMNLGGHVDF DDFVELMGPKLLAETADMIG VKELRDAFREFDTNGDGEIS TSELREAMRKLLGHQVGHRD IEEIIRDVDLNGDGRVDFEE FVRMMSR ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 167 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-25 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no BMRB 15197 . CaBP1 . . . . . 100.00 167 100.00 100.00 1.96e-115 . . . . 17532 1 2 no BMRB 15623 . CaBP1 . . . . . 100.00 167 100.00 100.00 1.96e-115 . . . . 17532 1 3 no BMRB 16862 . CaBP1 . . . . . 100.00 167 100.00 100.00 1.96e-115 . . . . 17532 1 4 no PDB 2LAN . "Nmr Structure Of Ca2+-Bound Cabp1 N-Domain With Rdc" . . . . . 100.00 167 100.00 100.00 1.96e-115 . . . . 17532 1 5 no PDB 2LAP . "Nmr Structure Of Ca2+-Bound Cabp1 C-Domain With Rdc" . . . . . 100.00 167 100.00 100.00 1.96e-115 . . . . 17532 1 6 no PDB 3OX5 . "Crystal Structure Of The Calcium Sensor Calcium-Binding Protein 1 (Cabp1)" . . . . . 91.02 153 100.00 100.00 7.55e-103 . . . . 17532 1 7 no PDB 3OX6 . "Crystal Structure Of The Calcium Sensor Calcium-Binding Protein 1 (Cabp1)" . . . . . 91.02 153 99.34 99.34 4.24e-102 . . . . 17532 1 8 no DBJ BAE24603 . "unnamed protein product [Mus musculus]" . . . . . 92.22 212 98.70 99.35 1.91e-102 . . . . 17532 1 9 no EMBL CAC43037 . "Caldendrin, isoform S1 [Rattus norvegicus]" . . . . . 100.00 167 99.40 99.40 2.17e-114 . . . . 17532 1 10 no EMBL CAD20347 . "caldendrin [Rattus norvegicus]" . . . . . 91.62 298 99.35 100.00 4.04e-103 . . . . 17532 1 11 no GB AAF25782 . "s-CaBP1 [Homo sapiens]" . . . . . 100.00 167 100.00 100.00 1.96e-115 . . . . 17532 1 12 no GB AAF25784 . "S-CaBP1 [Bos taurus]" . . . . . 100.00 167 99.40 99.40 2.17e-114 . . . . 17532 1 13 no GB AAF25787 . "S-CaBP1 [Mus musculus]" . . . . . 100.00 167 99.40 99.40 2.17e-114 . . . . 17532 1 14 no GB AAH30201 . "Calcium binding protein 1 [Homo sapiens]" . . . . . 91.62 370 99.35 100.00 2.26e-104 . . . . 17532 1 15 no GB ABM86439 . "calcium binding protein 1 (calbrain) [synthetic construct]" . . . . . 92.22 304 98.70 99.35 1.16e-102 . . . . 17532 1 16 no REF NP_001028847 . "calcium-binding protein 1 isoform 2 [Rattus norvegicus]" . . . . . 100.00 167 99.40 99.40 2.17e-114 . . . . 17532 1 17 no REF NP_001028848 . "calcium-binding protein 1 isoform 3 [Rattus norvegicus]" . . . . . 91.62 350 99.35 100.00 1.99e-103 . . . . 17532 1 18 no REF NP_001028849 . "calcium-binding protein 1 isoform 3 [Homo sapiens]" . . . . . 91.62 370 99.35 100.00 1.98e-104 . . . . 17532 1 19 no REF NP_001297641 . "calcium-binding protein 1 isoform 1 [Mus musculus]" . . . . . 91.62 350 99.35 100.00 2.01e-103 . . . . 17532 1 20 no REF NP_001297644 . "calcium-binding protein 1 isoform 3 [Mus musculus]" . . . . . 100.00 167 99.40 99.40 2.17e-114 . . . . 17532 1 21 no SP O88751 . "RecName: Full=Calcium-binding protein 1; Short=CaBP1; AltName: Full=Caldendrin" . . . . . 91.62 298 99.35 100.00 4.04e-103 . . . . 17532 1 22 no SP Q9NZU7 . "RecName: Full=Calcium-binding protein 1; Short=CaBP1; AltName: Full=Calbrain; AltName: Full=Caldendrin" . . . . . 91.62 370 99.35 100.00 1.98e-104 . . . . 17532 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . MET . 17532 1 2 . GLY . 17532 1 3 . ASN . 17532 1 4 . CYS . 17532 1 5 . VAL . 17532 1 6 . LYS . 17532 1 7 . TYR . 17532 1 8 . PRO . 17532 1 9 . LEU . 17532 1 10 . ARG . 17532 1 11 . ASN . 17532 1 12 . LEU . 17532 1 13 . SER . 17532 1 14 . ARG . 17532 1 15 . LYS . 17532 1 16 . ASP . 17532 1 17 . ARG . 17532 1 18 . SER . 17532 1 19 . LEU . 17532 1 20 . ARG . 17532 1 21 . PRO . 17532 1 22 . GLU . 17532 1 23 . GLU . 17532 1 24 . ILE . 17532 1 25 . GLU . 17532 1 26 . GLU . 17532 1 27 . LEU . 17532 1 28 . ARG . 17532 1 29 . GLU . 17532 1 30 . ALA . 17532 1 31 . PHE . 17532 1 32 . ARG . 17532 1 33 . GLU . 17532 1 34 . PHE . 17532 1 35 . ASP . 17532 1 36 . LYS . 17532 1 37 . ASP . 17532 1 38 . LYS . 17532 1 39 . ASP . 17532 1 40 . GLY . 17532 1 41 . TYR . 17532 1 42 . ILE . 17532 1 43 . ASN . 17532 1 44 . CYS . 17532 1 45 . ARG . 17532 1 46 . ASP . 17532 1 47 . LEU . 17532 1 48 . GLY . 17532 1 49 . ASN . 17532 1 50 . CYS . 17532 1 51 . MET . 17532 1 52 . ARG . 17532 1 53 . THR . 17532 1 54 . MET . 17532 1 55 . GLY . 17532 1 56 . TYR . 17532 1 57 . MET . 17532 1 58 . PRO . 17532 1 59 . THR . 17532 1 60 . GLU . 17532 1 61 . MET . 17532 1 62 . GLU . 17532 1 63 . LEU . 17532 1 64 . ILE . 17532 1 65 . GLU . 17532 1 66 . LEU . 17532 1 67 . SER . 17532 1 68 . GLN . 17532 1 69 . GLN . 17532 1 70 . ILE . 17532 1 71 . ASN . 17532 1 72 . MET . 17532 1 73 . ASN . 17532 1 74 . LEU . 17532 1 75 . GLY . 17532 1 76 . GLY . 17532 1 77 . HIS . 17532 1 78 . VAL . 17532 1 79 . ASP . 17532 1 80 . PHE . 17532 1 81 . ASP . 17532 1 82 . ASP . 17532 1 83 . PHE . 17532 1 84 . VAL . 17532 1 85 . GLU . 17532 1 86 . LEU . 17532 1 87 . MET . 17532 1 88 . GLY . 17532 1 89 . PRO . 17532 1 90 . LYS . 17532 1 91 . LEU . 17532 1 92 . LEU . 17532 1 93 . ALA . 17532 1 94 . GLU . 17532 1 95 . THR . 17532 1 96 . ALA . 17532 1 97 . ASP . 17532 1 98 . MET . 17532 1 99 . ILE . 17532 1 100 . GLY . 17532 1 101 . VAL . 17532 1 102 . LYS . 17532 1 103 . GLU . 17532 1 104 . LEU . 17532 1 105 . ARG . 17532 1 106 . ASP . 17532 1 107 . ALA . 17532 1 108 . PHE . 17532 1 109 . ARG . 17532 1 110 . GLU . 17532 1 111 . PHE . 17532 1 112 . ASP . 17532 1 113 . THR . 17532 1 114 . ASN . 17532 1 115 . GLY . 17532 1 116 . ASP . 17532 1 117 . GLY . 17532 1 118 . GLU . 17532 1 119 . ILE . 17532 1 120 . SER . 17532 1 121 . THR . 17532 1 122 . SER . 17532 1 123 . GLU . 17532 1 124 . LEU . 17532 1 125 . ARG . 17532 1 126 . GLU . 17532 1 127 . ALA . 17532 1 128 . MET . 17532 1 129 . ARG . 17532 1 130 . LYS . 17532 1 131 . LEU . 17532 1 132 . LEU . 17532 1 133 . GLY . 17532 1 134 . HIS . 17532 1 135 . GLN . 17532 1 136 . VAL . 17532 1 137 . GLY . 17532 1 138 . HIS . 17532 1 139 . ARG . 17532 1 140 . ASP . 17532 1 141 . ILE . 17532 1 142 . GLU . 17532 1 143 . GLU . 17532 1 144 . ILE . 17532 1 145 . ILE . 17532 1 146 . ARG . 17532 1 147 . ASP . 17532 1 148 . VAL . 17532 1 149 . ASP . 17532 1 150 . LEU . 17532 1 151 . ASN . 17532 1 152 . GLY . 17532 1 153 . ASP . 17532 1 154 . GLY . 17532 1 155 . ARG . 17532 1 156 . VAL . 17532 1 157 . ASP . 17532 1 158 . PHE . 17532 1 159 . GLU . 17532 1 160 . GLU . 17532 1 161 . PHE . 17532 1 162 . VAL . 17532 1 163 . ARG . 17532 1 164 . MET . 17532 1 165 . MET . 17532 1 166 . SER . 17532 1 167 . ARG . 17532 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . MET 1 1 17532 1 . GLY 2 2 17532 1 . ASN 3 3 17532 1 . CYS 4 4 17532 1 . VAL 5 5 17532 1 . LYS 6 6 17532 1 . TYR 7 7 17532 1 . PRO 8 8 17532 1 . LEU 9 9 17532 1 . ARG 10 10 17532 1 . ASN 11 11 17532 1 . LEU 12 12 17532 1 . SER 13 13 17532 1 . ARG 14 14 17532 1 . LYS 15 15 17532 1 . ASP 16 16 17532 1 . ARG 17 17 17532 1 . SER 18 18 17532 1 . LEU 19 19 17532 1 . ARG 20 20 17532 1 . PRO 21 21 17532 1 . GLU 22 22 17532 1 . GLU 23 23 17532 1 . ILE 24 24 17532 1 . GLU 25 25 17532 1 . GLU 26 26 17532 1 . LEU 27 27 17532 1 . ARG 28 28 17532 1 . GLU 29 29 17532 1 . ALA 30 30 17532 1 . PHE 31 31 17532 1 . ARG 32 32 17532 1 . GLU 33 33 17532 1 . PHE 34 34 17532 1 . ASP 35 35 17532 1 . LYS 36 36 17532 1 . ASP 37 37 17532 1 . LYS 38 38 17532 1 . ASP 39 39 17532 1 . GLY 40 40 17532 1 . TYR 41 41 17532 1 . ILE 42 42 17532 1 . ASN 43 43 17532 1 . CYS 44 44 17532 1 . ARG 45 45 17532 1 . ASP 46 46 17532 1 . LEU 47 47 17532 1 . GLY 48 48 17532 1 . ASN 49 49 17532 1 . CYS 50 50 17532 1 . MET 51 51 17532 1 . ARG 52 52 17532 1 . THR 53 53 17532 1 . MET 54 54 17532 1 . GLY 55 55 17532 1 . TYR 56 56 17532 1 . MET 57 57 17532 1 . PRO 58 58 17532 1 . THR 59 59 17532 1 . GLU 60 60 17532 1 . MET 61 61 17532 1 . GLU 62 62 17532 1 . LEU 63 63 17532 1 . ILE 64 64 17532 1 . GLU 65 65 17532 1 . LEU 66 66 17532 1 . SER 67 67 17532 1 . GLN 68 68 17532 1 . GLN 69 69 17532 1 . ILE 70 70 17532 1 . ASN 71 71 17532 1 . MET 72 72 17532 1 . ASN 73 73 17532 1 . LEU 74 74 17532 1 . GLY 75 75 17532 1 . GLY 76 76 17532 1 . HIS 77 77 17532 1 . VAL 78 78 17532 1 . ASP 79 79 17532 1 . PHE 80 80 17532 1 . ASP 81 81 17532 1 . ASP 82 82 17532 1 . PHE 83 83 17532 1 . VAL 84 84 17532 1 . GLU 85 85 17532 1 . LEU 86 86 17532 1 . MET 87 87 17532 1 . GLY 88 88 17532 1 . PRO 89 89 17532 1 . LYS 90 90 17532 1 . LEU 91 91 17532 1 . LEU 92 92 17532 1 . ALA 93 93 17532 1 . GLU 94 94 17532 1 . THR 95 95 17532 1 . ALA 96 96 17532 1 . ASP 97 97 17532 1 . MET 98 98 17532 1 . ILE 99 99 17532 1 . GLY 100 100 17532 1 . VAL 101 101 17532 1 . LYS 102 102 17532 1 . GLU 103 103 17532 1 . LEU 104 104 17532 1 . ARG 105 105 17532 1 . ASP 106 106 17532 1 . ALA 107 107 17532 1 . PHE 108 108 17532 1 . ARG 109 109 17532 1 . GLU 110 110 17532 1 . PHE 111 111 17532 1 . ASP 112 112 17532 1 . THR 113 113 17532 1 . ASN 114 114 17532 1 . GLY 115 115 17532 1 . ASP 116 116 17532 1 . GLY 117 117 17532 1 . GLU 118 118 17532 1 . ILE 119 119 17532 1 . SER 120 120 17532 1 . THR 121 121 17532 1 . SER 122 122 17532 1 . GLU 123 123 17532 1 . LEU 124 124 17532 1 . ARG 125 125 17532 1 . GLU 126 126 17532 1 . ALA 127 127 17532 1 . MET 128 128 17532 1 . ARG 129 129 17532 1 . LYS 130 130 17532 1 . LEU 131 131 17532 1 . LEU 132 132 17532 1 . GLY 133 133 17532 1 . HIS 134 134 17532 1 . GLN 135 135 17532 1 . VAL 136 136 17532 1 . GLY 137 137 17532 1 . HIS 138 138 17532 1 . ARG 139 139 17532 1 . ASP 140 140 17532 1 . ILE 141 141 17532 1 . GLU 142 142 17532 1 . GLU 143 143 17532 1 . ILE 144 144 17532 1 . ILE 145 145 17532 1 . ARG 146 146 17532 1 . ASP 147 147 17532 1 . VAL 148 148 17532 1 . ASP 149 149 17532 1 . LEU 150 150 17532 1 . ASN 151 151 17532 1 . GLY 152 152 17532 1 . ASP 153 153 17532 1 . GLY 154 154 17532 1 . ARG 155 155 17532 1 . VAL 156 156 17532 1 . ASP 157 157 17532 1 . PHE 158 158 17532 1 . GLU 159 159 17532 1 . GLU 160 160 17532 1 . PHE 161 161 17532 1 . VAL 162 162 17532 1 . ARG 163 163 17532 1 . MET 164 164 17532 1 . MET 165 165 17532 1 . SER 166 166 17532 1 . ARG 167 167 17532 1 stop_ save_ save_CA _Entity.Sf_category entity _Entity.Sf_framecode CA _Entity.Entry_ID 17532 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name CA _Entity.Type non-polymer _Entity.Polymer_common_type . _Entity.Polymer_type . _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code . _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer . _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID CA _Entity.Nonpolymer_comp_label $chem_comp_CA _Entity.Number_of_monomers . _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic . _Entity.Thiol_state . _Entity.Src_method . _Entity.Parent_entity_ID 2 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . CA . 17532 2 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 17532 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Subvariant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $CaBP1 . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 17532 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source _Entity_experimental_src_list.Entry_ID 17532 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $CaBP1 . 'recombinant technology' 'Escherichia coli' 'Escherichia coli' . 562 Escherichia coli . . . . . . . . . . . . . . . . pET3b . . . . . . 17532 1 stop_ save_ ################################# # Polymer residues and ligands # ################################# save_chem_comp_CA _Chem_comp.Sf_category chem_comp _Chem_comp.Sf_framecode chem_comp_CA _Chem_comp.Entry_ID 17532 _Chem_comp.ID CA _Chem_comp.Provenance . _Chem_comp.Name 'CALCIUM ION' _Chem_comp.Type non-polymer _Chem_comp.BMRB_code . _Chem_comp.PDB_code CA _Chem_comp.Ambiguous_flag no _Chem_comp.Initial_date 1999-07-08 _Chem_comp.Modified_date 2008-12-05 _Chem_comp.Release_status REL _Chem_comp.Replaced_by . _Chem_comp.Replaces . _Chem_comp.One_letter_code . _Chem_comp.Three_letter_code CA _Chem_comp.Number_atoms_all . _Chem_comp.Number_atoms_nh . _Chem_comp.PubChem_code . _Chem_comp.Subcomponent_list . _Chem_comp.InChI_code . _Chem_comp.Mon_nstd_flag . _Chem_comp.Mon_nstd_class . _Chem_comp.Mon_nstd_details . _Chem_comp.Mon_nstd_parent . _Chem_comp.Mon_nstd_parent_comp_ID . _Chem_comp.Std_deriv_one_letter_code . _Chem_comp.Std_deriv_three_letter_code . _Chem_comp.Std_deriv_BMRB_code . _Chem_comp.Std_deriv_PDB_code . _Chem_comp.Std_deriv_chem_comp_name . _Chem_comp.Synonyms . _Chem_comp.Formal_charge 2 _Chem_comp.Paramagnetic . _Chem_comp.Aromatic no _Chem_comp.Formula Ca _Chem_comp.Formula_weight 40.078 _Chem_comp.Formula_mono_iso_wt_nat . _Chem_comp.Formula_mono_iso_wt_13C . _Chem_comp.Formula_mono_iso_wt_15N . _Chem_comp.Formula_mono_iso_wt_13C_15N . _Chem_comp.Image_file_name . _Chem_comp.Image_file_format . _Chem_comp.Topo_file_name . _Chem_comp.Topo_file_format . _Chem_comp.Struct_file_name . _Chem_comp.Struct_file_format . _Chem_comp.Stereochem_param_file_name . _Chem_comp.Stereochem_param_file_format . _Chem_comp.Model_details . _Chem_comp.Model_erf . _Chem_comp.Model_source . _Chem_comp.Model_coordinates_details . _Chem_comp.Model_coordinates_missing_flag no _Chem_comp.Ideal_coordinates_details . _Chem_comp.Ideal_coordinates_missing_flag no _Chem_comp.Model_coordinates_db_code . _Chem_comp.Processing_site RCSB _Chem_comp.Vendor . _Chem_comp.Vendor_product_code . _Chem_comp.Details ; Information obtained from PDB's Chemical Component Dictionary at http://wwpdb-remediation.rutgers.edu/downloads.html Downloaded on Mon Apr 4 12:14:38 2011 ; _Chem_comp.DB_query_date . _Chem_comp.DB_last_query_revised_last_date . loop_ _Chem_comp_descriptor.Descriptor _Chem_comp_descriptor.Type _Chem_comp_descriptor.Program _Chem_comp_descriptor.Program_version _Chem_comp_descriptor.Entry_ID _Chem_comp_descriptor.Comp_ID BHPQYMZQTOCNFJ-UHFFFAOYAP InChIKey InChI 1.02b 17532 CA [Ca++] SMILES CACTVS 3.341 17532 CA [Ca++] SMILES_CANONICAL CACTVS 3.341 17532 CA [Ca+2] SMILES ACDLabs 10.04 17532 CA [Ca+2] SMILES 'OpenEye OEToolkits' 1.5.0 17532 CA [Ca+2] SMILES_CANONICAL 'OpenEye OEToolkits' 1.5.0 17532 CA InChI=1/Ca/q+2 InChI InChI 1.02b 17532 CA stop_ loop_ _Chem_comp_identifier.Identifier _Chem_comp_identifier.Type _Chem_comp_identifier.Program _Chem_comp_identifier.Program_version _Chem_comp_identifier.Entry_ID _Chem_comp_identifier.Comp_ID calcium 'SYSTEMATIC NAME' ACDLabs 10.04 17532 CA 'calcium(+2) cation' 'SYSTEMATIC NAME' 'OpenEye OEToolkits' 1.5.0 17532 CA stop_ loop_ _Chem_comp_atom.Atom_ID _Chem_comp_atom.BMRB_code _Chem_comp_atom.PDB_atom_ID _Chem_comp_atom.Alt_atom_ID _Chem_comp_atom.Auth_atom_ID _Chem_comp_atom.Type_symbol _Chem_comp_atom.Isotope_number _Chem_comp_atom.Chirality _Chem_comp_atom.Stereo_config _Chem_comp_atom.Charge _Chem_comp_atom.Partial_charge _Chem_comp_atom.Oxidation_number _Chem_comp_atom.Unpaired_electron_number _Chem_comp_atom.Align _Chem_comp_atom.Aromatic_flag _Chem_comp_atom.Leaving_atom_flag _Chem_comp_atom.Substruct_code _Chem_comp_atom.Ionizable _Chem_comp_atom.Drawing_2D_coord_x _Chem_comp_atom.Drawing_2D_coord_y _Chem_comp_atom.Model_Cartn_x _Chem_comp_atom.Model_Cartn_x_esd _Chem_comp_atom.Model_Cartn_y _Chem_comp_atom.Model_Cartn_y_esd _Chem_comp_atom.Model_Cartn_z _Chem_comp_atom.Model_Cartn_z_esd _Chem_comp_atom.Model_Cartn_x_ideal _Chem_comp_atom.Model_Cartn_y_ideal _Chem_comp_atom.Model_Cartn_z_ideal _Chem_comp_atom.PDBX_ordinal _Chem_comp_atom.Details _Chem_comp_atom.Entry_ID _Chem_comp_atom.Comp_ID CA . CA . . CA . . N 2 . . . . no no . . . . 0.000 . 0.000 . 0.000 . 0.000 0.000 0.000 1 . 17532 CA stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 17532 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 CaBP1 '[U-98% 13C; U-98% 15N]' . . 1 $CaBP1 . . 1.0 . . mM . . . . 17532 1 2 CA 'natural abundance' . . 2 $CA . . 5.0 . . mM . . . . 17532 1 3 TRIS 'natural abundance' . . . . . . 10.0 . . mM . . . . 17532 1 4 H2O 'natural abundance' . . . . . . 95 . . % . . . . 17532 1 5 D2O 'natural abundance' . . . . . . 5 . . % . . . . 17532 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 17532 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 0.01 . M 17532 1 pH 7.4 . pH 17532 1 pressure 1 . atm 17532 1 temperature 310 . K 17532 1 stop_ save_ ############################ # Computer software used # ############################ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 17532 _Software.ID 1 _Software.Name NMRPipe _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 17532 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 17532 1 stop_ save_ save_X-PLOR_NIH _Software.Sf_category software _Software.Sf_framecode X-PLOR_NIH _Software.Entry_ID 17532 _Software.ID 2 _Software.Name 'X-PLOR NIH' _Software.Version 2.23 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Schwieters, Kuszewski, Tjandra and Clore' . . 17532 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 17532 2 'structure solution' 17532 2 stop_ save_ save_SPARKY _Software.Sf_category software _Software.Sf_framecode SPARKY _Software.Entry_ID 17532 _Software.ID 3 _Software.Name SPARKY _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . 17532 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 17532 3 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 17532 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 17532 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker Avance . 800 . . . 17532 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 17532 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no 1 $NMR_spectrometer_expt . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17532 1 2 '3D CBCA(CO)NH' no 1 $NMR_spectrometer_expt . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17532 1 3 '3D HNCO' no 1 $NMR_spectrometer_expt . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17532 1 4 '3D HNCACB' no 1 $NMR_spectrometer_expt . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17532 1 5 '3D HBHA(CO)NH' no 1 $NMR_spectrometer_expt . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17532 1 6 '3D HCCH-TOCSY' no 1 $NMR_spectrometer_expt . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17532 1 7 '3D 1H-15N NOESY' no 1 $NMR_spectrometer_expt . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17532 1 stop_ save_ save_NMR_spectrometer_expt _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spectrometer_expt _NMR_spec_expt.Entry_ID 17532 _NMR_spec_expt.ID 1 _NMR_spec_expt.Name . _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_1 _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 17532 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 . indirect 0.251449530 . . . . . . . . . 17532 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . 17532 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 . indirect 0.101329118 . . . . . . . . . 17532 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 17532 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 17532 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 15 15 LYS HA H 1 4.313 0.04 . 1 . . . . 15 LYS HA . 17532 1 2 . 1 1 15 15 LYS HB2 H 1 1.870 0.04 . 2 . . . . 15 LYS HB2 . 17532 1 3 . 1 1 15 15 LYS HB3 H 1 1.800 0.04 . 2 . . . . 15 LYS HB3 . 17532 1 4 . 1 1 15 15 LYS C C 13 176.111 0.2 . 1 . . . . 15 LYS C . 17532 1 5 . 1 1 15 15 LYS CA C 13 56.722 0.2 . 1 . . . . 15 LYS CA . 17532 1 6 . 1 1 15 15 LYS CB C 13 32.883 0.2 . 1 . . . . 15 LYS CB . 17532 1 7 . 1 1 16 16 ASP H H 1 8.219 0.04 . 1 . . . . 16 ASP H . 17532 1 8 . 1 1 16 16 ASP HA H 1 4.612 0.04 . 1 . . . . 16 ASP HA . 17532 1 9 . 1 1 16 16 ASP HB2 H 1 2.657 0.04 . 2 . . . . 16 ASP HB2 . 17532 1 10 . 1 1 16 16 ASP HB3 H 1 2.735 0.04 . 2 . . . . 16 ASP HB3 . 17532 1 11 . 1 1 16 16 ASP C C 13 175.635 0.2 . 1 . . . . 16 ASP C . 17532 1 12 . 1 1 16 16 ASP CA C 13 54.049 0.2 . 1 . . . . 16 ASP CA . 17532 1 13 . 1 1 16 16 ASP CB C 13 41.190 0.2 . 1 . . . . 16 ASP CB . 17532 1 14 . 1 1 16 16 ASP N N 15 119.878 0.2 . 1 . . . . 16 ASP N . 17532 1 15 . 1 1 17 17 ARG H H 1 8.010 0.04 . 1 . . . . 17 ARG H . 17532 1 16 . 1 1 17 17 ARG HA H 1 4.405 0.04 . 1 . . . . 17 ARG HA . 17532 1 17 . 1 1 17 17 ARG HB2 H 1 1.940 0.04 . 2 . . . . 17 ARG HB2 . 17532 1 18 . 1 1 17 17 ARG C C 13 174.866 0.2 . 1 . . . . 17 ARG C . 17532 1 19 . 1 1 17 17 ARG CA C 13 55.474 0.2 . 1 . . . . 17 ARG CA . 17532 1 20 . 1 1 17 17 ARG CB C 13 30.781 0.2 . 1 . . . . 17 ARG CB . 17532 1 21 . 1 1 17 17 ARG N N 15 119.816 0.2 . 1 . . . . 17 ARG N . 17532 1 22 . 1 1 18 18 SER H H 1 8.030 0.04 . 1 . . . . 18 SER H . 17532 1 23 . 1 1 18 18 SER HA H 1 4.553 0.04 . 1 . . . . 18 SER HA . 17532 1 24 . 1 1 18 18 SER HB2 H 1 3.782 0.04 . 2 . . . . 18 SER HB2 . 17532 1 25 . 1 1 18 18 SER HB3 H 1 3.859 0.04 . 2 . . . . 18 SER HB3 . 17532 1 26 . 1 1 18 18 SER C C 13 174.494 0.2 . 1 . . . . 18 SER C . 17532 1 27 . 1 1 18 18 SER CA C 13 57.617 0.2 . 1 . . . . 18 SER CA . 17532 1 28 . 1 1 18 18 SER CB C 13 64.608 0.2 . 1 . . . . 18 SER CB . 17532 1 29 . 1 1 18 18 SER N N 15 115.342 0.2 . 1 . . . . 18 SER N . 17532 1 30 . 1 1 19 19 LEU H H 1 8.458 0.04 . 1 . . . . 19 LEU H . 17532 1 31 . 1 1 19 19 LEU HA H 1 4.373 0.04 . 1 . . . . 19 LEU HA . 17532 1 32 . 1 1 19 19 LEU HB2 H 1 1.687 0.04 . 2 . . . . 19 LEU HB2 . 17532 1 33 . 1 1 19 19 LEU HB3 H 1 1.400 0.04 . 2 . . . . 19 LEU HB3 . 17532 1 34 . 1 1 19 19 LEU HG H 1 1.714 0.04 . 1 . . . . 19 LEU HG . 17532 1 35 . 1 1 19 19 LEU HD11 H 1 0.784 0.04 . 1 . . . . 19 LEU HD11 . 17532 1 36 . 1 1 19 19 LEU HD12 H 1 0.784 0.04 . 1 . . . . 19 LEU HD12 . 17532 1 37 . 1 1 19 19 LEU HD13 H 1 0.784 0.04 . 1 . . . . 19 LEU HD13 . 17532 1 38 . 1 1 19 19 LEU HD21 H 1 0.821 0.04 . 1 . . . . 19 LEU HD21 . 17532 1 39 . 1 1 19 19 LEU HD22 H 1 0.821 0.04 . 1 . . . . 19 LEU HD22 . 17532 1 40 . 1 1 19 19 LEU HD23 H 1 0.821 0.04 . 1 . . . . 19 LEU HD23 . 17532 1 41 . 1 1 19 19 LEU C C 13 177.506 0.2 . 1 . . . . 19 LEU C . 17532 1 42 . 1 1 19 19 LEU CA C 13 55.360 0.2 . 1 . . . . 19 LEU CA . 17532 1 43 . 1 1 19 19 LEU CB C 13 42.398 0.2 . 1 . . . . 19 LEU CB . 17532 1 44 . 1 1 19 19 LEU CD1 C 13 26.250 0.2 . 1 . . . . 19 LEU CD1 . 17532 1 45 . 1 1 19 19 LEU CD2 C 13 23.600 0.2 . 1 . . . . 19 LEU CD2 . 17532 1 46 . 1 1 19 19 LEU N N 15 123.381 0.2 . 1 . . . . 19 LEU N . 17532 1 47 . 1 1 20 20 ARG H H 1 9.584 0.04 . 1 . . . . 20 ARG H . 17532 1 48 . 1 1 20 20 ARG N N 15 123.683 0.2 . 1 . . . . 20 ARG N . 17532 1 49 . 1 1 21 21 PRO HA H 1 4.281 0.04 . 1 . . . . 21 PRO HA . 17532 1 50 . 1 1 21 21 PRO HB2 H 1 2.486 0.04 . 2 . . . . 21 PRO HB2 . 17532 1 51 . 1 1 21 21 PRO HB3 H 1 2.055 0.04 . 2 . . . . 21 PRO HB3 . 17532 1 52 . 1 1 21 21 PRO C C 13 179.232 0.2 . 1 . . . . 21 PRO C . 17532 1 53 . 1 1 21 21 PRO CA C 13 66.350 0.2 . 1 . . . . 21 PRO CA . 17532 1 54 . 1 1 21 21 PRO CB C 13 31.740 0.2 . 1 . . . . 21 PRO CB . 17532 1 55 . 1 1 22 22 GLU H H 1 9.993 0.04 . 1 . . . . 22 GLU H . 17532 1 56 . 1 1 22 22 GLU HA H 1 4.220 0.04 . 1 . . . . 22 GLU HA . 17532 1 57 . 1 1 22 22 GLU HB2 H 1 2.092 0.04 . 2 . . . . 22 GLU HB2 . 17532 1 58 . 1 1 22 22 GLU C C 13 179.487 0.2 . 1 . . . . 22 GLU C . 17532 1 59 . 1 1 22 22 GLU CA C 13 59.799 0.2 . 1 . . . . 22 GLU CA . 17532 1 60 . 1 1 22 22 GLU CB C 13 28.274 0.2 . 1 . . . . 22 GLU CB . 17532 1 61 . 1 1 22 22 GLU N N 15 116.700 0.2 . 1 . . . . 22 GLU N . 17532 1 62 . 1 1 23 23 GLU H H 1 7.438 0.04 . 1 . . . . 23 GLU H . 17532 1 63 . 1 1 23 23 GLU HA H 1 4.280 0.04 . 1 . . . . 23 GLU HA . 17532 1 64 . 1 1 23 23 GLU HB2 H 1 2.654 0.04 . 2 . . . . 23 GLU HB2 . 17532 1 65 . 1 1 23 23 GLU HB3 H 1 2.203 0.04 . 2 . . . . 23 GLU HB3 . 17532 1 66 . 1 1 23 23 GLU C C 13 178.784 0.2 . 1 . . . . 23 GLU C . 17532 1 67 . 1 1 23 23 GLU CA C 13 58.808 0.2 . 1 . . . . 23 GLU CA . 17532 1 68 . 1 1 23 23 GLU CB C 13 30.357 0.2 . 1 . . . . 23 GLU CB . 17532 1 69 . 1 1 23 23 GLU N N 15 120.542 0.2 . 1 . . . . 23 GLU N . 17532 1 70 . 1 1 24 24 ILE H H 1 7.792 0.04 . 1 . . . . 24 ILE H . 17532 1 71 . 1 1 24 24 ILE HA H 1 3.812 0.04 . 1 . . . . 24 ILE HA . 17532 1 72 . 1 1 24 24 ILE HB H 1 2.203 0.04 . 1 . . . . 24 ILE HB . 17532 1 73 . 1 1 24 24 ILE HG12 H 1 1.659 0.04 . 1 . . . . 24 ILE HG12 . 17532 1 74 . 1 1 24 24 ILE HG21 H 1 1.117 0.04 . 1 . . . . 24 ILE HG21 . 17532 1 75 . 1 1 24 24 ILE HG22 H 1 1.117 0.04 . 1 . . . . 24 ILE HG22 . 17532 1 76 . 1 1 24 24 ILE HG23 H 1 1.117 0.04 . 1 . . . . 24 ILE HG23 . 17532 1 77 . 1 1 24 24 ILE HD11 H 1 0.850 0.04 . 1 . . . . 24 ILE HD11 . 17532 1 78 . 1 1 24 24 ILE HD12 H 1 0.850 0.04 . 1 . . . . 24 ILE HD12 . 17532 1 79 . 1 1 24 24 ILE HD13 H 1 0.850 0.04 . 1 . . . . 24 ILE HD13 . 17532 1 80 . 1 1 24 24 ILE C C 13 178.421 0.2 . 1 . . . . 24 ILE C . 17532 1 81 . 1 1 24 24 ILE CA C 13 64.733 0.2 . 1 . . . . 24 ILE CA . 17532 1 82 . 1 1 24 24 ILE CB C 13 36.916 0.2 . 1 . . . . 24 ILE CB . 17532 1 83 . 1 1 24 24 ILE CG1 C 13 29.230 0.2 . 1 . . . . 24 ILE CG1 . 17532 1 84 . 1 1 24 24 ILE CG2 C 13 17.510 0.2 . 1 . . . . 24 ILE CG2 . 17532 1 85 . 1 1 24 24 ILE CD1 C 13 12.040 0.2 . 1 . . . . 24 ILE CD1 . 17532 1 86 . 1 1 24 24 ILE N N 15 120.005 0.2 . 1 . . . . 24 ILE N . 17532 1 87 . 1 1 25 25 GLU H H 1 8.062 0.04 . 1 . . . . 25 GLU H . 17532 1 88 . 1 1 25 25 GLU HA H 1 4.226 0.04 . 1 . . . . 25 GLU HA . 17532 1 89 . 1 1 25 25 GLU HB2 H 1 2.154 0.04 . 2 . . . . 25 GLU HB2 . 17532 1 90 . 1 1 25 25 GLU C C 13 178.921 0.2 . 1 . . . . 25 GLU C . 17532 1 91 . 1 1 25 25 GLU CA C 13 59.247 0.2 . 1 . . . . 25 GLU CA . 17532 1 92 . 1 1 25 25 GLU CB C 13 28.862 0.2 . 1 . . . . 25 GLU CB . 17532 1 93 . 1 1 25 25 GLU N N 15 118.385 0.2 . 1 . . . . 25 GLU N . 17532 1 94 . 1 1 26 26 GLU H H 1 7.588 0.04 . 1 . . . . 26 GLU H . 17532 1 95 . 1 1 26 26 GLU HA H 1 4.231 0.04 . 1 . . . . 26 GLU HA . 17532 1 96 . 1 1 26 26 GLU HB2 H 1 2.284 0.04 . 2 . . . . 26 GLU HB2 . 17532 1 97 . 1 1 26 26 GLU C C 13 180.202 0.2 . 1 . . . . 26 GLU C . 17532 1 98 . 1 1 26 26 GLU CA C 13 59.470 0.2 . 1 . . . . 26 GLU CA . 17532 1 99 . 1 1 26 26 GLU CB C 13 29.486 0.2 . 1 . . . . 26 GLU CB . 17532 1 100 . 1 1 26 26 GLU N N 15 120.114 0.2 . 1 . . . . 26 GLU N . 17532 1 101 . 1 1 27 27 LEU H H 1 8.084 0.04 . 1 . . . . 27 LEU H . 17532 1 102 . 1 1 27 27 LEU HA H 1 4.477 0.04 . 1 . . . . 27 LEU HA . 17532 1 103 . 1 1 27 27 LEU HB2 H 1 2.569 0.04 . 2 . . . . 27 LEU HB2 . 17532 1 104 . 1 1 27 27 LEU HB3 H 1 1.713 0.04 . 2 . . . . 27 LEU HB3 . 17532 1 105 . 1 1 27 27 LEU HG H 1 2.018 0.04 . 1 . . . . 27 LEU HG . 17532 1 106 . 1 1 27 27 LEU HD11 H 1 0.817 0.04 . 1 . . . . 27 LEU HD11 . 17532 1 107 . 1 1 27 27 LEU HD12 H 1 0.817 0.04 . 1 . . . . 27 LEU HD12 . 17532 1 108 . 1 1 27 27 LEU HD13 H 1 0.817 0.04 . 1 . . . . 27 LEU HD13 . 17532 1 109 . 1 1 27 27 LEU HD21 H 1 0.803 0.04 . 1 . . . . 27 LEU HD21 . 17532 1 110 . 1 1 27 27 LEU HD22 H 1 0.803 0.04 . 1 . . . . 27 LEU HD22 . 17532 1 111 . 1 1 27 27 LEU HD23 H 1 0.803 0.04 . 1 . . . . 27 LEU HD23 . 17532 1 112 . 1 1 27 27 LEU C C 13 178.746 0.2 . 1 . . . . 27 LEU C . 17532 1 113 . 1 1 27 27 LEU CA C 13 58.107 0.2 . 1 . . . . 27 LEU CA . 17532 1 114 . 1 1 27 27 LEU CB C 13 41.595 0.2 . 1 . . . . 27 LEU CB . 17532 1 115 . 1 1 27 27 LEU CG C 13 27.480 0.2 . 1 . . . . 27 LEU CG . 17532 1 116 . 1 1 27 27 LEU CD1 C 13 26.920 0.2 . 1 . . . . 27 LEU CD1 . 17532 1 117 . 1 1 27 27 LEU CD2 C 13 24.530 0.2 . 1 . . . . 27 LEU CD2 . 17532 1 118 . 1 1 27 27 LEU N N 15 120.400 0.2 . 1 . . . . 27 LEU N . 17532 1 119 . 1 1 28 28 ARG H H 1 8.886 0.04 . 1 . . . . 28 ARG H . 17532 1 120 . 1 1 28 28 ARG HA H 1 3.719 0.04 . 1 . . . . 28 ARG HA . 17532 1 121 . 1 1 28 28 ARG HB2 H 1 1.843 0.04 . 2 . . . . 28 ARG HB2 . 17532 1 122 . 1 1 28 28 ARG HB3 H 1 1.768 0.04 . 2 . . . . 28 ARG HB3 . 17532 1 123 . 1 1 28 28 ARG C C 13 178.664 0.2 . 1 . . . . 28 ARG C . 17532 1 124 . 1 1 28 28 ARG CA C 13 59.920 0.2 . 1 . . . . 28 ARG CA . 17532 1 125 . 1 1 28 28 ARG CB C 13 29.953 0.2 . 1 . . . . 28 ARG CB . 17532 1 126 . 1 1 28 28 ARG N N 15 121.879 0.2 . 1 . . . . 28 ARG N . 17532 1 127 . 1 1 29 29 GLU H H 1 8.128 0.04 . 1 . . . . 29 GLU H . 17532 1 128 . 1 1 29 29 GLU HA H 1 4.066 0.04 . 1 . . . . 29 GLU HA . 17532 1 129 . 1 1 29 29 GLU HB2 H 1 2.204 0.04 . 2 . . . . 29 GLU HB2 . 17532 1 130 . 1 1 29 29 GLU C C 13 179.041 0.2 . 1 . . . . 29 GLU C . 17532 1 131 . 1 1 29 29 GLU CA C 13 59.364 0.2 . 1 . . . . 29 GLU CA . 17532 1 132 . 1 1 29 29 GLU CB C 13 29.648 0.2 . 1 . . . . 29 GLU CB . 17532 1 133 . 1 1 29 29 GLU N N 15 118.934 0.2 . 1 . . . . 29 GLU N . 17532 1 134 . 1 1 30 30 ALA H H 1 7.766 0.04 . 1 . . . . 30 ALA H . 17532 1 135 . 1 1 30 30 ALA HA H 1 4.351 0.04 . 1 . . . . 30 ALA HA . 17532 1 136 . 1 1 30 30 ALA HB1 H 1 1.774 0.04 . 1 . . . . 30 ALA HB1 . 17532 1 137 . 1 1 30 30 ALA HB2 H 1 1.774 0.04 . 1 . . . . 30 ALA HB2 . 17532 1 138 . 1 1 30 30 ALA HB3 H 1 1.774 0.04 . 1 . . . . 30 ALA HB3 . 17532 1 139 . 1 1 30 30 ALA C C 13 178.784 0.2 . 1 . . . . 30 ALA C . 17532 1 140 . 1 1 30 30 ALA CA C 13 55.407 0.2 . 1 . . . . 30 ALA CA . 17532 1 141 . 1 1 30 30 ALA CB C 13 18.774 0.2 . 1 . . . . 30 ALA CB . 17532 1 142 . 1 1 30 30 ALA N N 15 122.423 0.2 . 1 . . . . 30 ALA N . 17532 1 143 . 1 1 31 31 PHE H H 1 8.570 0.04 . 1 . . . . 31 PHE H . 17532 1 144 . 1 1 31 31 PHE HA H 1 3.648 0.04 . 1 . . . . 31 PHE HA . 17532 1 145 . 1 1 31 31 PHE HB2 H 1 3.244 0.04 . 2 . . . . 31 PHE HB2 . 17532 1 146 . 1 1 31 31 PHE HB3 H 1 2.954 0.04 . 2 . . . . 31 PHE HB3 . 17532 1 147 . 1 1 31 31 PHE HD1 H 1 6.551 0.04 . 3 . . . . 31 PHE HD1 . 17532 1 148 . 1 1 31 31 PHE HD2 H 1 6.551 0.04 . 3 . . . . 31 PHE HD2 . 17532 1 149 . 1 1 31 31 PHE HE1 H 1 6.938 0.04 . 3 . . . . 31 PHE HE1 . 17532 1 150 . 1 1 31 31 PHE HE2 H 1 6.938 0.04 . 3 . . . . 31 PHE HE2 . 17532 1 151 . 1 1 31 31 PHE HZ H 1 7.412 0.04 . 1 . . . . 31 PHE HZ . 17532 1 152 . 1 1 31 31 PHE C C 13 177.519 0.2 . 1 . . . . 31 PHE C . 17532 1 153 . 1 1 31 31 PHE CA C 13 62.131 0.2 . 1 . . . . 31 PHE CA . 17532 1 154 . 1 1 31 31 PHE CB C 13 40.423 0.2 . 1 . . . . 31 PHE CB . 17532 1 155 . 1 1 31 31 PHE N N 15 118.696 0.2 . 1 . . . . 31 PHE N . 17532 1 156 . 1 1 32 32 ARG H H 1 8.459 0.04 . 1 . . . . 32 ARG H . 17532 1 157 . 1 1 32 32 ARG HA H 1 3.976 0.04 . 1 . . . . 32 ARG HA . 17532 1 158 . 1 1 32 32 ARG C C 13 179.020 0.2 . 1 . . . . 32 ARG C . 17532 1 159 . 1 1 32 32 ARG CA C 13 59.393 0.2 . 1 . . . . 32 ARG CA . 17532 1 160 . 1 1 32 32 ARG CB C 13 30.406 0.2 . 1 . . . . 32 ARG CB . 17532 1 161 . 1 1 32 32 ARG N N 15 115.937 0.2 . 1 . . . . 32 ARG N . 17532 1 162 . 1 1 33 33 GLU H H 1 7.566 0.04 . 1 . . . . 33 GLU H . 17532 1 163 . 1 1 33 33 GLU HA H 1 3.891 0.04 . 1 . . . . 33 GLU HA . 17532 1 164 . 1 1 33 33 GLU HB2 H 1 2.081 0.04 . 2 . . . . 33 GLU HB2 . 17532 1 165 . 1 1 33 33 GLU C C 13 177.197 0.2 . 1 . . . . 33 GLU C . 17532 1 166 . 1 1 33 33 GLU CA C 13 58.589 0.2 . 1 . . . . 33 GLU CA . 17532 1 167 . 1 1 33 33 GLU CB C 13 29.058 0.2 . 1 . . . . 33 GLU CB . 17532 1 168 . 1 1 33 33 GLU N N 15 118.273 0.2 . 1 . . . . 33 GLU N . 17532 1 169 . 1 1 34 34 PHE H H 1 7.326 0.04 . 1 . . . . 34 PHE H . 17532 1 170 . 1 1 34 34 PHE HA H 1 4.262 0.04 . 1 . . . . 34 PHE HA . 17532 1 171 . 1 1 34 34 PHE HB2 H 1 2.607 0.04 . 2 . . . . 34 PHE HB2 . 17532 1 172 . 1 1 34 34 PHE HB3 H 1 3.042 0.04 . 2 . . . . 34 PHE HB3 . 17532 1 173 . 1 1 34 34 PHE HD1 H 1 7.534 0.04 . 3 . . . . 34 PHE HD1 . 17532 1 174 . 1 1 34 34 PHE HD2 H 1 7.534 0.04 . 3 . . . . 34 PHE HD2 . 17532 1 175 . 1 1 34 34 PHE HE1 H 1 7.438 0.04 . 3 . . . . 34 PHE HE1 . 17532 1 176 . 1 1 34 34 PHE HE2 H 1 7.438 0.04 . 3 . . . . 34 PHE HE2 . 17532 1 177 . 1 1 34 34 PHE HZ H 1 7.240 0.04 . 1 . . . . 34 PHE HZ . 17532 1 178 . 1 1 34 34 PHE C C 13 175.852 0.2 . 1 . . . . 34 PHE C . 17532 1 179 . 1 1 34 34 PHE CA C 13 59.722 0.2 . 1 . . . . 34 PHE CA . 17532 1 180 . 1 1 34 34 PHE CB C 13 39.757 0.2 . 1 . . . . 34 PHE CB . 17532 1 181 . 1 1 34 34 PHE N N 15 114.060 0.2 . 1 . . . . 34 PHE N . 17532 1 182 . 1 1 35 35 ASP H H 1 7.768 0.04 . 1 . . . . 35 ASP H . 17532 1 183 . 1 1 35 35 ASP HA H 1 5.067 0.04 . 1 . . . . 35 ASP HA . 17532 1 184 . 1 1 35 35 ASP HB2 H 1 2.643 0.04 . 2 . . . . 35 ASP HB2 . 17532 1 185 . 1 1 35 35 ASP HB3 H 1 1.822 0.04 . 2 . . . . 35 ASP HB3 . 17532 1 186 . 1 1 35 35 ASP C C 13 178.458 0.2 . 1 . . . . 35 ASP C . 17532 1 187 . 1 1 35 35 ASP CA C 13 52.535 0.2 . 1 . . . . 35 ASP CA . 17532 1 188 . 1 1 35 35 ASP CB C 13 38.991 0.2 . 1 . . . . 35 ASP CB . 17532 1 189 . 1 1 35 35 ASP N N 15 122.494 0.2 . 1 . . . . 35 ASP N . 17532 1 190 . 1 1 36 36 LYS H H 1 7.837 0.04 . 1 . . . . 36 LYS H . 17532 1 191 . 1 1 36 36 LYS HA H 1 3.984 0.04 . 1 . . . . 36 LYS HA . 17532 1 192 . 1 1 36 36 LYS HB2 H 1 1.891 0.04 . 2 . . . . 36 LYS HB2 . 17532 1 193 . 1 1 36 36 LYS C C 13 177.340 0.2 . 1 . . . . 36 LYS C . 17532 1 194 . 1 1 36 36 LYS CA C 13 59.397 0.2 . 1 . . . . 36 LYS CA . 17532 1 195 . 1 1 36 36 LYS CB C 13 32.345 0.2 . 1 . . . . 36 LYS CB . 17532 1 196 . 1 1 36 36 LYS N N 15 122.532 0.2 . 1 . . . . 36 LYS N . 17532 1 197 . 1 1 37 37 ASP H H 1 8.260 0.04 . 1 . . . . 37 ASP H . 17532 1 198 . 1 1 37 37 ASP HA H 1 4.539 0.04 . 1 . . . . 37 ASP HA . 17532 1 199 . 1 1 37 37 ASP HB2 H 1 2.615 0.04 . 2 . . . . 37 ASP HB2 . 17532 1 200 . 1 1 37 37 ASP HB3 H 1 2.991 0.04 . 2 . . . . 37 ASP HB3 . 17532 1 201 . 1 1 37 37 ASP C C 13 175.369 0.2 . 1 . . . . 37 ASP C . 17532 1 202 . 1 1 37 37 ASP CA C 13 52.845 0.2 . 1 . . . . 37 ASP CA . 17532 1 203 . 1 1 37 37 ASP CB C 13 39.172 0.2 . 1 . . . . 37 ASP CB . 17532 1 204 . 1 1 37 37 ASP N N 15 113.541 0.2 . 1 . . . . 37 ASP N . 17532 1 205 . 1 1 38 38 LYS H H 1 7.588 0.04 . 1 . . . . 38 LYS H . 17532 1 206 . 1 1 38 38 LYS HA H 1 3.946 0.04 . 1 . . . . 38 LYS HA . 17532 1 207 . 1 1 38 38 LYS C C 13 175.784 0.2 . 1 . . . . 38 LYS C . 17532 1 208 . 1 1 38 38 LYS CA C 13 57.538 0.2 . 1 . . . . 38 LYS CA . 17532 1 209 . 1 1 38 38 LYS CB C 13 29.258 0.2 . 1 . . . . 38 LYS CB . 17532 1 210 . 1 1 38 38 LYS N N 15 114.730 0.2 . 1 . . . . 38 LYS N . 17532 1 211 . 1 1 39 39 ASP H H 1 8.301 0.04 . 1 . . . . 39 ASP H . 17532 1 212 . 1 1 39 39 ASP HA H 1 4.756 0.04 . 1 . . . . 39 ASP HA . 17532 1 213 . 1 1 39 39 ASP HB2 H 1 2.634 0.04 . 2 . . . . 39 ASP HB2 . 17532 1 214 . 1 1 39 39 ASP HB3 H 1 3.198 0.04 . 2 . . . . 39 ASP HB3 . 17532 1 215 . 1 1 39 39 ASP C C 13 177.146 0.2 . 1 . . . . 39 ASP C . 17532 1 216 . 1 1 39 39 ASP CA C 13 53.432 0.2 . 1 . . . . 39 ASP CA . 17532 1 217 . 1 1 39 39 ASP CB C 13 41.107 0.2 . 1 . . . . 39 ASP CB . 17532 1 218 . 1 1 39 39 ASP N N 15 118.583 0.2 . 1 . . . . 39 ASP N . 17532 1 219 . 1 1 40 40 GLY H H 1 10.140 0.04 . 1 . . . . 40 GLY H . 17532 1 220 . 1 1 40 40 GLY HA2 H 1 4.120 0.04 . 2 . . . . 40 GLY HA2 . 17532 1 221 . 1 1 40 40 GLY HA3 H 1 3.545 0.04 . 2 . . . . 40 GLY HA3 . 17532 1 222 . 1 1 40 40 GLY C C 13 173.383 0.2 . 1 . . . . 40 GLY C . 17532 1 223 . 1 1 40 40 GLY CA C 13 45.033 0.2 . 1 . . . . 40 GLY CA . 17532 1 224 . 1 1 40 40 GLY N N 15 111.561 0.2 . 1 . . . . 40 GLY N . 17532 1 225 . 1 1 41 41 TYR H H 1 7.989 0.04 . 1 . . . . 41 TYR H . 17532 1 226 . 1 1 41 41 TYR HA H 1 5.640 0.04 . 1 . . . . 41 TYR HA . 17532 1 227 . 1 1 41 41 TYR HB2 H 1 2.662 0.04 . 2 . . . . 41 TYR HB2 . 17532 1 228 . 1 1 41 41 TYR HB3 H 1 2.833 0.04 . 2 . . . . 41 TYR HB3 . 17532 1 229 . 1 1 41 41 TYR HD1 H 1 6.690 0.04 . 3 . . . . 41 TYR HD1 . 17532 1 230 . 1 1 41 41 TYR HD2 H 1 6.690 0.04 . 3 . . . . 41 TYR HD2 . 17532 1 231 . 1 1 41 41 TYR HE1 H 1 6.819 0.04 . 3 . . . . 41 TYR HE1 . 17532 1 232 . 1 1 41 41 TYR HE2 H 1 6.819 0.04 . 3 . . . . 41 TYR HE2 . 17532 1 233 . 1 1 41 41 TYR C C 13 176.661 0.2 . 1 . . . . 41 TYR C . 17532 1 234 . 1 1 41 41 TYR CA C 13 56.740 0.2 . 1 . . . . 41 TYR CA . 17532 1 235 . 1 1 41 41 TYR CB C 13 42.766 0.2 . 1 . . . . 41 TYR CB . 17532 1 236 . 1 1 41 41 TYR N N 15 115.987 0.2 . 1 . . . . 41 TYR N . 17532 1 237 . 1 1 42 42 ILE H H 1 9.347 0.04 . 1 . . . . 42 ILE H . 17532 1 238 . 1 1 42 42 ILE HA H 1 4.859 0.04 . 1 . . . . 42 ILE HA . 17532 1 239 . 1 1 42 42 ILE HB H 1 1.941 0.04 . 1 . . . . 42 ILE HB . 17532 1 240 . 1 1 42 42 ILE HG12 H 1 1.209 0.04 . 2 . . . . 42 ILE HG12 . 17532 1 241 . 1 1 42 42 ILE HG13 H 1 0.932 0.04 . 2 . . . . 42 ILE HG13 . 17532 1 242 . 1 1 42 42 ILE HG21 H 1 0.298 0.04 . 1 . . . . 42 ILE HG21 . 17532 1 243 . 1 1 42 42 ILE HG22 H 1 0.298 0.04 . 1 . . . . 42 ILE HG22 . 17532 1 244 . 1 1 42 42 ILE HG23 H 1 0.298 0.04 . 1 . . . . 42 ILE HG23 . 17532 1 245 . 1 1 42 42 ILE HD11 H 1 0.335 0.04 . 1 . . . . 42 ILE HD11 . 17532 1 246 . 1 1 42 42 ILE HD12 H 1 0.335 0.04 . 1 . . . . 42 ILE HD12 . 17532 1 247 . 1 1 42 42 ILE HD13 H 1 0.335 0.04 . 1 . . . . 42 ILE HD13 . 17532 1 248 . 1 1 42 42 ILE C C 13 174.798 0.2 . 1 . . . . 42 ILE C . 17532 1 249 . 1 1 42 42 ILE CA C 13 60.017 0.2 . 1 . . . . 42 ILE CA . 17532 1 250 . 1 1 42 42 ILE CB C 13 40.728 0.2 . 1 . . . . 42 ILE CB . 17532 1 251 . 1 1 42 42 ILE CG1 C 13 25.560 0.2 . 1 . . . . 42 ILE CG1 . 17532 1 252 . 1 1 42 42 ILE CG2 C 13 16.300 0.2 . 1 . . . . 42 ILE CG2 . 17532 1 253 . 1 1 42 42 ILE CD1 C 13 13.870 0.2 . 1 . . . . 42 ILE CD1 . 17532 1 254 . 1 1 42 42 ILE N N 15 118.700 0.2 . 1 . . . . 42 ILE N . 17532 1 255 . 1 1 43 43 ASN H H 1 8.852 0.04 . 1 . . . . 43 ASN H . 17532 1 256 . 1 1 43 43 ASN HA H 1 5.073 0.04 . 1 . . . . 43 ASN HA . 17532 1 257 . 1 1 43 43 ASN HB2 H 1 3.058 0.04 . 2 . . . . 43 ASN HB2 . 17532 1 258 . 1 1 43 43 ASN HB3 H 1 3.092 0.04 . 2 . . . . 43 ASN HB3 . 17532 1 259 . 1 1 43 43 ASN C C 13 176.122 0.2 . 1 . . . . 43 ASN C . 17532 1 260 . 1 1 43 43 ASN CA C 13 52.189 0.2 . 1 . . . . 43 ASN CA . 17532 1 261 . 1 1 43 43 ASN CB C 13 39.963 0.2 . 1 . . . . 43 ASN CB . 17532 1 262 . 1 1 43 43 ASN N N 15 120.700 0.2 . 1 . . . . 43 ASN N . 17532 1 263 . 1 1 44 44 CYS H H 1 8.519 0.04 . 1 . . . . 44 CYS H . 17532 1 264 . 1 1 44 44 CYS HA H 1 3.946 0.04 . 1 . . . . 44 CYS HA . 17532 1 265 . 1 1 44 44 CYS HB2 H 1 3.020 0.04 . 2 . . . . 44 CYS HB2 . 17532 1 266 . 1 1 44 44 CYS HB3 H 1 2.878 0.04 . 2 . . . . 44 CYS HB3 . 17532 1 267 . 1 1 44 44 CYS CA C 13 62.439 0.2 . 1 . . . . 44 CYS CA . 17532 1 268 . 1 1 44 44 CYS CB C 13 26.680 0.2 . 1 . . . . 44 CYS CB . 17532 1 269 . 1 1 44 44 CYS N N 15 118.771 0.2 . 1 . . . . 44 CYS N . 17532 1 270 . 1 1 45 45 ARG C C 13 178.109 0.2 . 1 . . . . 45 ARG C . 17532 1 271 . 1 1 45 45 ARG CA C 13 58.780 0.2 . 1 . . . . 45 ARG CA . 17532 1 272 . 1 1 45 45 ARG CB C 13 29.450 0.2 . 1 . . . . 45 ARG CB . 17532 1 273 . 1 1 46 46 ASP H H 1 8.165 0.04 . 1 . . . . 46 ASP H . 17532 1 274 . 1 1 46 46 ASP HA H 1 4.700 0.04 . 1 . . . . 46 ASP HA . 17532 1 275 . 1 1 46 46 ASP HB2 H 1 2.736 0.04 . 2 . . . . 46 ASP HB2 . 17532 1 276 . 1 1 46 46 ASP HB3 H 1 2.860 0.04 . 2 . . . . 46 ASP HB3 . 17532 1 277 . 1 1 46 46 ASP CA C 13 56.116 0.2 . 1 . . . . 46 ASP CA . 17532 1 278 . 1 1 46 46 ASP CB C 13 41.874 0.2 . 1 . . . . 46 ASP CB . 17532 1 279 . 1 1 46 46 ASP N N 15 118.981 0.2 . 1 . . . . 46 ASP N . 17532 1 280 . 1 1 47 47 LEU H H 1 7.946 0.04 . 1 . . . . 47 LEU H . 17532 1 281 . 1 1 47 47 LEU HA H 1 3.786 0.04 . 1 . . . . 47 LEU HA . 17532 1 282 . 1 1 47 47 LEU HB2 H 1 1.909 0.04 . 2 . . . . 47 LEU HB2 . 17532 1 283 . 1 1 47 47 LEU HB3 H 1 1.626 0.04 . 2 . . . . 47 LEU HB3 . 17532 1 284 . 1 1 47 47 LEU HG H 1 1.735 0.04 . 1 . . . . 47 LEU HG . 17532 1 285 . 1 1 47 47 LEU HD11 H 1 1.051 0.04 . 1 . . . . 47 LEU HD11 . 17532 1 286 . 1 1 47 47 LEU HD12 H 1 1.051 0.04 . 1 . . . . 47 LEU HD12 . 17532 1 287 . 1 1 47 47 LEU HD13 H 1 1.051 0.04 . 1 . . . . 47 LEU HD13 . 17532 1 288 . 1 1 47 47 LEU HD21 H 1 0.946 0.04 . 1 . . . . 47 LEU HD21 . 17532 1 289 . 1 1 47 47 LEU HD22 H 1 0.946 0.04 . 1 . . . . 47 LEU HD22 . 17532 1 290 . 1 1 47 47 LEU HD23 H 1 0.946 0.04 . 1 . . . . 47 LEU HD23 . 17532 1 291 . 1 1 47 47 LEU C C 13 178.476 0.2 . 1 . . . . 47 LEU C . 17532 1 292 . 1 1 47 47 LEU CA C 13 59.027 0.2 . 1 . . . . 47 LEU CA . 17532 1 293 . 1 1 47 47 LEU CB C 13 41.908 0.2 . 1 . . . . 47 LEU CB . 17532 1 294 . 1 1 47 47 LEU CG C 13 27.130 0.2 . 1 . . . . 47 LEU CG . 17532 1 295 . 1 1 47 47 LEU CD1 C 13 24.950 0.2 . 1 . . . . 47 LEU CD1 . 17532 1 296 . 1 1 47 47 LEU CD2 C 13 26.050 0.2 . 1 . . . . 47 LEU CD2 . 17532 1 297 . 1 1 47 47 LEU N N 15 120.831 0.2 . 1 . . . . 47 LEU N . 17532 1 298 . 1 1 48 48 GLY H H 1 8.425 0.04 . 1 . . . . 48 GLY H . 17532 1 299 . 1 1 48 48 GLY HA2 H 1 3.896 0.04 . 2 . . . . 48 GLY HA2 . 17532 1 300 . 1 1 48 48 GLY HA3 H 1 3.685 0.04 . 2 . . . . 48 GLY HA3 . 17532 1 301 . 1 1 48 48 GLY C C 13 175.488 0.2 . 1 . . . . 48 GLY C . 17532 1 302 . 1 1 48 48 GLY CA C 13 47.923 0.2 . 1 . . . . 48 GLY CA . 17532 1 303 . 1 1 48 48 GLY N N 15 106.142 0.2 . 1 . . . . 48 GLY N . 17532 1 304 . 1 1 49 49 ASN H H 1 7.851 0.04 . 1 . . . . 49 ASN H . 17532 1 305 . 1 1 49 49 ASN HA H 1 4.497 0.04 . 1 . . . . 49 ASN HA . 17532 1 306 . 1 1 49 49 ASN HB2 H 1 2.703 0.04 . 2 . . . . 49 ASN HB2 . 17532 1 307 . 1 1 49 49 ASN C C 13 177.492 0.2 . 1 . . . . 49 ASN C . 17532 1 308 . 1 1 49 49 ASN CA C 13 55.812 0.2 . 1 . . . . 49 ASN CA . 17532 1 309 . 1 1 49 49 ASN CB C 13 37.888 0.2 . 1 . . . . 49 ASN CB . 17532 1 310 . 1 1 49 49 ASN N N 15 119.524 0.2 . 1 . . . . 49 ASN N . 17532 1 311 . 1 1 50 50 CYS H H 1 8.186 0.04 . 1 . . . . 50 CYS H . 17532 1 312 . 1 1 50 50 CYS HA H 1 3.529 0.04 . 1 . . . . 50 CYS HA . 17532 1 313 . 1 1 50 50 CYS HB2 H 1 2.661 0.04 . 2 . . . . 50 CYS HB2 . 17532 1 314 . 1 1 50 50 CYS HB3 H 1 2.215 0.04 . 2 . . . . 50 CYS HB3 . 17532 1 315 . 1 1 50 50 CYS C C 13 176.805 0.2 . 1 . . . . 50 CYS C . 17532 1 316 . 1 1 50 50 CYS CA C 13 63.013 0.2 . 1 . . . . 50 CYS CA . 17532 1 317 . 1 1 50 50 CYS CB C 13 26.453 0.2 . 1 . . . . 50 CYS CB . 17532 1 318 . 1 1 50 50 CYS N N 15 122.947 0.2 . 1 . . . . 50 CYS N . 17532 1 319 . 1 1 51 51 MET H H 1 8.436 0.04 . 1 . . . . 51 MET H . 17532 1 320 . 1 1 51 51 MET HA H 1 3.988 0.04 . 1 . . . . 51 MET HA . 17532 1 321 . 1 1 51 51 MET HB2 H 1 2.360 0.04 . 2 . . . . 51 MET HB2 . 17532 1 322 . 1 1 51 51 MET HB3 H 1 2.581 0.04 . 2 . . . . 51 MET HB3 . 17532 1 323 . 1 1 51 51 MET C C 13 178.111 0.2 . 1 . . . . 51 MET C . 17532 1 324 . 1 1 51 51 MET CA C 13 60.917 0.2 . 1 . . . . 51 MET CA . 17532 1 325 . 1 1 51 51 MET CB C 13 33.146 0.2 . 1 . . . . 51 MET CB . 17532 1 326 . 1 1 51 51 MET N N 15 117.780 0.2 . 1 . . . . 51 MET N . 17532 1 327 . 1 1 52 52 ARG H H 1 7.961 0.04 . 1 . . . . 52 ARG H . 17532 1 328 . 1 1 52 52 ARG HA H 1 4.444 0.04 . 1 . . . . 52 ARG HA . 17532 1 329 . 1 1 52 52 ARG HB2 H 1 2.002 0.04 . 2 . . . . 52 ARG HB2 . 17532 1 330 . 1 1 52 52 ARG C C 13 181.061 0.2 . 1 . . . . 52 ARG C . 17532 1 331 . 1 1 52 52 ARG CA C 13 59.549 0.2 . 1 . . . . 52 ARG CA . 17532 1 332 . 1 1 52 52 ARG CB C 13 30.289 0.2 . 1 . . . . 52 ARG CB . 17532 1 333 . 1 1 52 52 ARG N N 15 117.844 0.2 . 1 . . . . 52 ARG N . 17532 1 334 . 1 1 53 53 THR H H 1 8.118 0.04 . 1 . . . . 53 THR H . 17532 1 335 . 1 1 53 53 THR HA H 1 4.195 0.04 . 1 . . . . 53 THR HA . 17532 1 336 . 1 1 53 53 THR HB H 1 4.585 0.04 . 1 . . . . 53 THR HB . 17532 1 337 . 1 1 53 53 THR HG21 H 1 1.590 0.04 . 1 . . . . 53 THR HG21 . 17532 1 338 . 1 1 53 53 THR HG22 H 1 1.590 0.04 . 1 . . . . 53 THR HG22 . 17532 1 339 . 1 1 53 53 THR HG23 H 1 1.590 0.04 . 1 . . . . 53 THR HG23 . 17532 1 340 . 1 1 53 53 THR C C 13 175.566 0.2 . 1 . . . . 53 THR C . 17532 1 341 . 1 1 53 53 THR CA C 13 66.342 0.2 . 1 . . . . 53 THR CA . 17532 1 342 . 1 1 53 53 THR CB C 13 69.113 0.2 . 1 . . . . 53 THR CB . 17532 1 343 . 1 1 53 53 THR CG2 C 13 21.780 0.2 . 1 . . . . 53 THR CG2 . 17532 1 344 . 1 1 53 53 THR N N 15 116.830 0.2 . 1 . . . . 53 THR N . 17532 1 345 . 1 1 54 54 MET H H 1 7.599 0.04 . 1 . . . . 54 MET H . 17532 1 346 . 1 1 54 54 MET HA H 1 4.630 0.04 . 1 . . . . 54 MET HA . 17532 1 347 . 1 1 54 54 MET HB2 H 1 2.435 0.04 . 2 . . . . 54 MET HB2 . 17532 1 348 . 1 1 54 54 MET HB3 H 1 2.304 0.04 . 2 . . . . 54 MET HB3 . 17532 1 349 . 1 1 54 54 MET C C 13 175.777 0.2 . 1 . . . . 54 MET C . 17532 1 350 . 1 1 54 54 MET CA C 13 55.894 0.2 . 1 . . . . 54 MET CA . 17532 1 351 . 1 1 54 54 MET CB C 13 33.038 0.2 . 1 . . . . 54 MET CB . 17532 1 352 . 1 1 54 54 MET N N 15 118.060 0.2 . 1 . . . . 54 MET N . 17532 1 353 . 1 1 55 55 GLY H H 1 7.776 0.04 . 1 . . . . 55 GLY H . 17532 1 354 . 1 1 55 55 GLY HA2 H 1 4.286 0.04 . 2 . . . . 55 GLY HA2 . 17532 1 355 . 1 1 55 55 GLY HA3 H 1 3.682 0.04 . 2 . . . . 55 GLY HA3 . 17532 1 356 . 1 1 55 55 GLY C C 13 173.298 0.2 . 1 . . . . 55 GLY C . 17532 1 357 . 1 1 55 55 GLY CA C 13 45.239 0.2 . 1 . . . . 55 GLY CA . 17532 1 358 . 1 1 55 55 GLY N N 15 105.740 0.2 . 1 . . . . 55 GLY N . 17532 1 359 . 1 1 56 56 TYR H H 1 7.854 0.04 . 1 . . . . 56 TYR H . 17532 1 360 . 1 1 56 56 TYR HA H 1 4.556 0.04 . 1 . . . . 56 TYR HA . 17532 1 361 . 1 1 56 56 TYR HB2 H 1 2.605 0.04 . 2 . . . . 56 TYR HB2 . 17532 1 362 . 1 1 56 56 TYR HB3 H 1 2.808 0.04 . 2 . . . . 56 TYR HB3 . 17532 1 363 . 1 1 56 56 TYR CA C 13 57.243 0.2 . 1 . . . . 56 TYR CA . 17532 1 364 . 1 1 56 56 TYR CB C 13 39.752 0.2 . 1 . . . . 56 TYR CB . 17532 1 365 . 1 1 56 56 TYR N N 15 122.043 0.2 . 1 . . . . 56 TYR N . 17532 1 366 . 1 1 58 58 PRO HA H 1 4.732 0.04 . 1 . . . . 58 PRO HA . 17532 1 367 . 1 1 58 58 PRO HB2 H 1 2.204 0.04 . 2 . . . . 58 PRO HB2 . 17532 1 368 . 1 1 58 58 PRO HB3 H 1 1.999 0.04 . 2 . . . . 58 PRO HB3 . 17532 1 369 . 1 1 58 58 PRO C C 13 177.733 0.2 . 1 . . . . 58 PRO C . 17532 1 370 . 1 1 58 58 PRO CA C 13 61.950 0.2 . 1 . . . . 58 PRO CA . 17532 1 371 . 1 1 58 58 PRO CB C 13 31.980 0.2 . 1 . . . . 58 PRO CB . 17532 1 372 . 1 1 59 59 THR H H 1 8.636 0.04 . 1 . . . . 59 THR H . 17532 1 373 . 1 1 59 59 THR HA H 1 4.500 0.04 . 1 . . . . 59 THR HA . 17532 1 374 . 1 1 59 59 THR HB H 1 4.734 0.04 . 1 . . . . 59 THR HB . 17532 1 375 . 1 1 59 59 THR HG21 H 1 1.402 0.04 . 1 . . . . 59 THR HG21 . 17532 1 376 . 1 1 59 59 THR HG22 H 1 1.402 0.04 . 1 . . . . 59 THR HG22 . 17532 1 377 . 1 1 59 59 THR HG23 H 1 1.402 0.04 . 1 . . . . 59 THR HG23 . 17532 1 378 . 1 1 59 59 THR C C 13 175.209 0.2 . 1 . . . . 59 THR C . 17532 1 379 . 1 1 59 59 THR CA C 13 60.747 0.2 . 1 . . . . 59 THR CA . 17532 1 380 . 1 1 59 59 THR CB C 13 70.849 0.2 . 1 . . . . 59 THR CB . 17532 1 381 . 1 1 59 59 THR CG2 C 13 21.940 0.2 . 1 . . . . 59 THR CG2 . 17532 1 382 . 1 1 59 59 THR N N 15 112.866 0.2 . 1 . . . . 59 THR N . 17532 1 383 . 1 1 60 60 GLU H H 1 8.839 0.04 . 1 . . . . 60 GLU H . 17532 1 384 . 1 1 60 60 GLU HA H 1 4.052 0.04 . 1 . . . . 60 GLU HA . 17532 1 385 . 1 1 60 60 GLU HB2 H 1 2.331 0.04 . 2 . . . . 60 GLU HB2 . 17532 1 386 . 1 1 60 60 GLU HB3 H 1 2.097 0.04 . 2 . . . . 60 GLU HB3 . 17532 1 387 . 1 1 60 60 GLU C C 13 179.393 0.2 . 1 . . . . 60 GLU C . 17532 1 388 . 1 1 60 60 GLU CA C 13 60.166 0.2 . 1 . . . . 60 GLU CA . 17532 1 389 . 1 1 60 60 GLU CB C 13 29.382 0.2 . 1 . . . . 60 GLU CB . 17532 1 390 . 1 1 60 60 GLU N N 15 121.022 0.2 . 1 . . . . 60 GLU N . 17532 1 391 . 1 1 61 61 MET H H 1 8.363 0.04 . 1 . . . . 61 MET H . 17532 1 392 . 1 1 61 61 MET HA H 1 4.296 0.04 . 1 . . . . 61 MET HA . 17532 1 393 . 1 1 61 61 MET HB2 H 1 2.076 0.04 . 2 . . . . 61 MET HB2 . 17532 1 394 . 1 1 61 61 MET C C 13 178.435 0.2 . 1 . . . . 61 MET C . 17532 1 395 . 1 1 61 61 MET CA C 13 58.262 0.2 . 1 . . . . 61 MET CA . 17532 1 396 . 1 1 61 61 MET CB C 13 31.967 0.2 . 1 . . . . 61 MET CB . 17532 1 397 . 1 1 61 61 MET N N 15 116.428 0.2 . 1 . . . . 61 MET N . 17532 1 398 . 1 1 62 62 GLU H H 1 7.849 0.04 . 1 . . . . 62 GLU H . 17532 1 399 . 1 1 62 62 GLU HA H 1 4.129 0.04 . 1 . . . . 62 GLU HA . 17532 1 400 . 1 1 62 62 GLU HB2 H 1 2.332 0.04 . 2 . . . . 62 GLU HB2 . 17532 1 401 . 1 1 62 62 GLU HB3 H 1 2.084 0.04 . 2 . . . . 62 GLU HB3 . 17532 1 402 . 1 1 62 62 GLU C C 13 179.314 0.2 . 1 . . . . 62 GLU C . 17532 1 403 . 1 1 62 62 GLU CA C 13 59.167 0.2 . 1 . . . . 62 GLU CA . 17532 1 404 . 1 1 62 62 GLU CB C 13 30.260 0.2 . 1 . . . . 62 GLU CB . 17532 1 405 . 1 1 62 62 GLU N N 15 120.855 0.2 . 1 . . . . 62 GLU N . 17532 1 406 . 1 1 63 63 LEU H H 1 7.946 0.04 . 1 . . . . 63 LEU H . 17532 1 407 . 1 1 63 63 LEU HA H 1 4.140 0.04 . 1 . . . . 63 LEU HA . 17532 1 408 . 1 1 63 63 LEU HB2 H 1 1.899 0.04 . 2 . . . . 63 LEU HB2 . 17532 1 409 . 1 1 63 63 LEU HB3 H 1 1.647 0.04 . 2 . . . . 63 LEU HB3 . 17532 1 410 . 1 1 63 63 LEU HD11 H 1 0.902 0.04 . 1 . . . . 63 LEU HD11 . 17532 1 411 . 1 1 63 63 LEU HD12 H 1 0.902 0.04 . 1 . . . . 63 LEU HD12 . 17532 1 412 . 1 1 63 63 LEU HD13 H 1 0.902 0.04 . 1 . . . . 63 LEU HD13 . 17532 1 413 . 1 1 63 63 LEU HD21 H 1 0.864 0.04 . 1 . . . . 63 LEU HD21 . 17532 1 414 . 1 1 63 63 LEU HD22 H 1 0.864 0.04 . 1 . . . . 63 LEU HD22 . 17532 1 415 . 1 1 63 63 LEU HD23 H 1 0.864 0.04 . 1 . . . . 63 LEU HD23 . 17532 1 416 . 1 1 63 63 LEU C C 13 180.109 0.2 . 1 . . . . 63 LEU C . 17532 1 417 . 1 1 63 63 LEU CA C 13 57.760 0.2 . 1 . . . . 63 LEU CA . 17532 1 418 . 1 1 63 63 LEU CB C 13 41.335 0.2 . 1 . . . . 63 LEU CB . 17532 1 419 . 1 1 63 63 LEU CD1 C 13 24.920 0.2 . 1 . . . . 63 LEU CD1 . 17532 1 420 . 1 1 63 63 LEU CD2 C 13 22.910 0.2 . 1 . . . . 63 LEU CD2 . 17532 1 421 . 1 1 63 63 LEU N N 15 119.060 0.2 . 1 . . . . 63 LEU N . 17532 1 422 . 1 1 64 64 ILE H H 1 8.188 0.04 . 1 . . . . 64 ILE H . 17532 1 423 . 1 1 64 64 ILE HA H 1 3.769 0.04 . 1 . . . . 64 ILE HA . 17532 1 424 . 1 1 64 64 ILE HB H 1 2.058 0.04 . 1 . . . . 64 ILE HB . 17532 1 425 . 1 1 64 64 ILE HG12 H 1 1.820 0.04 . 2 . . . . 64 ILE HG12 . 17532 1 426 . 1 1 64 64 ILE HG13 H 1 1.183 0.04 . 2 . . . . 64 ILE HG13 . 17532 1 427 . 1 1 64 64 ILE HG21 H 1 0.937 0.04 . 1 . . . . 64 ILE HG21 . 17532 1 428 . 1 1 64 64 ILE HG22 H 1 0.937 0.04 . 1 . . . . 64 ILE HG22 . 17532 1 429 . 1 1 64 64 ILE HG23 H 1 0.937 0.04 . 1 . . . . 64 ILE HG23 . 17532 1 430 . 1 1 64 64 ILE HD11 H 1 0.909 0.04 . 1 . . . . 64 ILE HD11 . 17532 1 431 . 1 1 64 64 ILE HD12 H 1 0.909 0.04 . 1 . . . . 64 ILE HD12 . 17532 1 432 . 1 1 64 64 ILE HD13 H 1 0.909 0.04 . 1 . . . . 64 ILE HD13 . 17532 1 433 . 1 1 64 64 ILE C C 13 178.748 0.2 . 1 . . . . 64 ILE C . 17532 1 434 . 1 1 64 64 ILE CA C 13 65.336 0.2 . 1 . . . . 64 ILE CA . 17532 1 435 . 1 1 64 64 ILE CB C 13 37.936 0.2 . 1 . . . . 64 ILE CB . 17532 1 436 . 1 1 64 64 ILE CG2 C 13 17.090 0.2 . 1 . . . . 64 ILE CG2 . 17532 1 437 . 1 1 64 64 ILE CD1 C 13 13.250 0.2 . 1 . . . . 64 ILE CD1 . 17532 1 438 . 1 1 64 64 ILE N N 15 123.431 0.2 . 1 . . . . 64 ILE N . 17532 1 439 . 1 1 65 65 GLU H H 1 8.002 0.04 . 1 . . . . 65 GLU H . 17532 1 440 . 1 1 65 65 GLU HA H 1 4.086 0.04 . 1 . . . . 65 GLU HA . 17532 1 441 . 1 1 65 65 GLU HB2 H 1 2.218 0.04 . 2 . . . . 65 GLU HB2 . 17532 1 442 . 1 1 65 65 GLU C C 13 179.579 0.2 . 1 . . . . 65 GLU C . 17532 1 443 . 1 1 65 65 GLU CA C 13 59.758 0.2 . 1 . . . . 65 GLU CA . 17532 1 444 . 1 1 65 65 GLU CB C 13 29.627 0.2 . 1 . . . . 65 GLU CB . 17532 1 445 . 1 1 65 65 GLU N N 15 121.012 0.2 . 1 . . . . 65 GLU N . 17532 1 446 . 1 1 66 66 LEU H H 1 8.381 0.04 . 1 . . . . 66 LEU H . 17532 1 447 . 1 1 66 66 LEU HA H 1 4.182 0.04 . 1 . . . . 66 LEU HA . 17532 1 448 . 1 1 66 66 LEU HB2 H 1 1.878 0.04 . 2 . . . . 66 LEU HB2 . 17532 1 449 . 1 1 66 66 LEU HB3 H 1 1.559 0.04 . 2 . . . . 66 LEU HB3 . 17532 1 450 . 1 1 66 66 LEU C C 13 178.783 0.2 . 1 . . . . 66 LEU C . 17532 1 451 . 1 1 66 66 LEU CA C 13 57.985 0.2 . 1 . . . . 66 LEU CA . 17532 1 452 . 1 1 66 66 LEU CB C 13 42.436 0.2 . 1 . . . . 66 LEU CB . 17532 1 453 . 1 1 66 66 LEU N N 15 120.046 0.2 . 1 . . . . 66 LEU N . 17532 1 454 . 1 1 67 67 SER H H 1 8.257 0.04 . 1 . . . . 67 SER H . 17532 1 455 . 1 1 67 67 SER HA H 1 4.245 0.04 . 1 . . . . 67 SER HA . 17532 1 456 . 1 1 67 67 SER HB2 H 1 3.937 0.04 . 2 . . . . 67 SER HB2 . 17532 1 457 . 1 1 67 67 SER HB3 H 1 3.937 0.04 . 2 . . . . 67 SER HB3 . 17532 1 458 . 1 1 67 67 SER C C 13 176.098 0.2 . 1 . . . . 67 SER C . 17532 1 459 . 1 1 67 67 SER CA C 13 61.880 0.2 . 1 . . . . 67 SER CA . 17532 1 460 . 1 1 67 67 SER CB C 13 62.959 0.2 . 1 . . . . 67 SER CB . 17532 1 461 . 1 1 67 67 SER N N 15 114.185 0.2 . 1 . . . . 67 SER N . 17532 1 462 . 1 1 68 68 GLN H H 1 7.942 0.04 . 1 . . . . 68 GLN H . 17532 1 463 . 1 1 68 68 GLN HA H 1 4.198 0.04 . 1 . . . . 68 GLN HA . 17532 1 464 . 1 1 68 68 GLN HB2 H 1 2.256 0.04 . 2 . . . . 68 GLN HB2 . 17532 1 465 . 1 1 68 68 GLN C C 13 178.260 0.2 . 1 . . . . 68 GLN C . 17532 1 466 . 1 1 68 68 GLN CA C 13 59.027 0.2 . 1 . . . . 68 GLN CA . 17532 1 467 . 1 1 68 68 GLN CB C 13 28.269 0.2 . 1 . . . . 68 GLN CB . 17532 1 468 . 1 1 68 68 GLN N N 15 120.772 0.2 . 1 . . . . 68 GLN N . 17532 1 469 . 1 1 69 69 GLN H H 1 7.849 0.04 . 1 . . . . 69 GLN H . 17532 1 470 . 1 1 69 69 GLN HA H 1 4.131 0.04 . 1 . . . . 69 GLN HA . 17532 1 471 . 1 1 69 69 GLN HB2 H 1 2.272 0.04 . 2 . . . . 69 GLN HB2 . 17532 1 472 . 1 1 69 69 GLN C C 13 178.706 0.2 . 1 . . . . 69 GLN C . 17532 1 473 . 1 1 69 69 GLN CA C 13 59.081 0.2 . 1 . . . . 69 GLN CA . 17532 1 474 . 1 1 69 69 GLN CB C 13 28.577 0.2 . 1 . . . . 69 GLN CB . 17532 1 475 . 1 1 69 69 GLN N N 15 118.945 0.2 . 1 . . . . 69 GLN N . 17532 1 476 . 1 1 70 70 ILE H H 1 8.537 0.04 . 1 . . . . 70 ILE H . 17532 1 477 . 1 1 70 70 ILE HA H 1 3.752 0.04 . 1 . . . . 70 ILE HA . 17532 1 478 . 1 1 70 70 ILE HB H 1 1.914 0.04 . 1 . . . . 70 ILE HB . 17532 1 479 . 1 1 70 70 ILE HG12 H 1 1.782 0.04 . 2 . . . . 70 ILE HG12 . 17532 1 480 . 1 1 70 70 ILE HG13 H 1 1.050 0.04 . 2 . . . . 70 ILE HG13 . 17532 1 481 . 1 1 70 70 ILE HG21 H 1 0.732 0.04 . 1 . . . . 70 ILE HG21 . 17532 1 482 . 1 1 70 70 ILE HG22 H 1 0.732 0.04 . 1 . . . . 70 ILE HG22 . 17532 1 483 . 1 1 70 70 ILE HG23 H 1 0.732 0.04 . 1 . . . . 70 ILE HG23 . 17532 1 484 . 1 1 70 70 ILE HD11 H 1 0.780 0.04 . 1 . . . . 70 ILE HD11 . 17532 1 485 . 1 1 70 70 ILE HD12 H 1 0.780 0.04 . 1 . . . . 70 ILE HD12 . 17532 1 486 . 1 1 70 70 ILE HD13 H 1 0.780 0.04 . 1 . . . . 70 ILE HD13 . 17532 1 487 . 1 1 70 70 ILE C C 13 179.185 0.2 . 1 . . . . 70 ILE C . 17532 1 488 . 1 1 70 70 ILE CA C 13 64.358 0.2 . 1 . . . . 70 ILE CA . 17532 1 489 . 1 1 70 70 ILE CB C 13 38.049 0.2 . 1 . . . . 70 ILE CB . 17532 1 490 . 1 1 70 70 ILE CG2 C 13 17.780 0.2 . 1 . . . . 70 ILE CG2 . 17532 1 491 . 1 1 70 70 ILE CD1 C 13 14.810 0.2 . 1 . . . . 70 ILE CD1 . 17532 1 492 . 1 1 70 70 ILE N N 15 119.589 0.2 . 1 . . . . 70 ILE N . 17532 1 493 . 1 1 71 71 ASN H H 1 8.609 0.04 . 1 . . . . 71 ASN H . 17532 1 494 . 1 1 71 71 ASN HA H 1 4.361 0.04 . 1 . . . . 71 ASN HA . 17532 1 495 . 1 1 71 71 ASN HB2 H 1 2.773 0.04 . 2 . . . . 71 ASN HB2 . 17532 1 496 . 1 1 71 71 ASN HB3 H 1 2.955 0.04 . 2 . . . . 71 ASN HB3 . 17532 1 497 . 1 1 71 71 ASN C C 13 176.871 0.2 . 1 . . . . 71 ASN C . 17532 1 498 . 1 1 71 71 ASN CA C 13 56.098 0.2 . 1 . . . . 71 ASN CA . 17532 1 499 . 1 1 71 71 ASN CB C 13 37.980 0.2 . 1 . . . . 71 ASN CB . 17532 1 500 . 1 1 71 71 ASN N N 15 119.932 0.2 . 1 . . . . 71 ASN N . 17532 1 501 . 1 1 72 72 MET H H 1 8.203 0.04 . 1 . . . . 72 MET H . 17532 1 502 . 1 1 72 72 MET HA H 1 4.414 0.04 . 1 . . . . 72 MET HA . 17532 1 503 . 1 1 72 72 MET HB2 H 1 2.151 0.04 . 2 . . . . 72 MET HB2 . 17532 1 504 . 1 1 72 72 MET HB3 H 1 2.089 0.04 . 2 . . . . 72 MET HB3 . 17532 1 505 . 1 1 72 72 MET C C 13 177.643 0.2 . 1 . . . . 72 MET C . 17532 1 506 . 1 1 72 72 MET CA C 13 57.838 0.2 . 1 . . . . 72 MET CA . 17532 1 507 . 1 1 72 72 MET CB C 13 33.106 0.2 . 1 . . . . 72 MET CB . 17532 1 508 . 1 1 72 72 MET N N 15 117.207 0.2 . 1 . . . . 72 MET N . 17532 1 509 . 1 1 73 73 ASN H H 1 8.224 0.04 . 1 . . . . 73 ASN H . 17532 1 510 . 1 1 73 73 ASN HA H 1 4.996 0.04 . 1 . . . . 73 ASN HA . 17532 1 511 . 1 1 73 73 ASN HB2 H 1 2.908 0.04 . 2 . . . . 73 ASN HB2 . 17532 1 512 . 1 1 73 73 ASN C C 13 176.247 0.2 . 1 . . . . 73 ASN C . 17532 1 513 . 1 1 73 73 ASN CA C 13 54.514 0.2 . 1 . . . . 73 ASN CA . 17532 1 514 . 1 1 73 73 ASN CB C 13 40.081 0.2 . 1 . . . . 73 ASN CB . 17532 1 515 . 1 1 73 73 ASN N N 15 114.487 0.2 . 1 . . . . 73 ASN N . 17532 1 516 . 1 1 74 74 LEU H H 1 7.619 0.04 . 1 . . . . 74 LEU H . 17532 1 517 . 1 1 74 74 LEU HA H 1 4.852 0.04 . 1 . . . . 74 LEU HA . 17532 1 518 . 1 1 74 74 LEU HB2 H 1 2.411 0.04 . 2 . . . . 74 LEU HB2 . 17532 1 519 . 1 1 74 74 LEU HB3 H 1 2.028 0.04 . 2 . . . . 74 LEU HB3 . 17532 1 520 . 1 1 74 74 LEU HG H 1 1.635 0.04 . 1 . . . . 74 LEU HG . 17532 1 521 . 1 1 74 74 LEU HD11 H 1 1.018 0.04 . 1 . . . . 74 LEU HD11 . 17532 1 522 . 1 1 74 74 LEU HD12 H 1 1.018 0.04 . 1 . . . . 74 LEU HD12 . 17532 1 523 . 1 1 74 74 LEU HD13 H 1 1.018 0.04 . 1 . . . . 74 LEU HD13 . 17532 1 524 . 1 1 74 74 LEU HD21 H 1 1.008 0.04 . 1 . . . . 74 LEU HD21 . 17532 1 525 . 1 1 74 74 LEU HD22 H 1 1.008 0.04 . 1 . . . . 74 LEU HD22 . 17532 1 526 . 1 1 74 74 LEU HD23 H 1 1.008 0.04 . 1 . . . . 74 LEU HD23 . 17532 1 527 . 1 1 74 74 LEU C C 13 177.946 0.2 . 1 . . . . 74 LEU C . 17532 1 528 . 1 1 74 74 LEU CA C 13 54.640 0.2 . 1 . . . . 74 LEU CA . 17532 1 529 . 1 1 74 74 LEU CB C 13 42.995 0.2 . 1 . . . . 74 LEU CB . 17532 1 530 . 1 1 74 74 LEU CG C 13 27.260 0.2 . 1 . . . . 74 LEU CG . 17532 1 531 . 1 1 74 74 LEU CD1 C 13 25.780 0.2 . 1 . . . . 74 LEU CD1 . 17532 1 532 . 1 1 74 74 LEU CD2 C 13 23.080 0.2 . 1 . . . . 74 LEU CD2 . 17532 1 533 . 1 1 74 74 LEU N N 15 118.929 0.2 . 1 . . . . 74 LEU N . 17532 1 534 . 1 1 75 75 GLY H H 1 7.923 0.04 . 1 . . . . 75 GLY H . 17532 1 535 . 1 1 75 75 GLY HA2 H 1 4.044 0.04 . 2 . . . . 75 GLY HA2 . 17532 1 536 . 1 1 75 75 GLY HA3 H 1 4.044 0.04 . 2 . . . . 75 GLY HA3 . 17532 1 537 . 1 1 75 75 GLY C C 13 175.578 0.2 . 1 . . . . 75 GLY C . 17532 1 538 . 1 1 75 75 GLY CA C 13 46.576 0.2 . 1 . . . . 75 GLY CA . 17532 1 539 . 1 1 75 75 GLY N N 15 107.269 0.2 . 1 . . . . 75 GLY N . 17532 1 540 . 1 1 76 76 GLY H H 1 8.121 0.04 . 1 . . . . 76 GLY H . 17532 1 541 . 1 1 76 76 GLY HA2 H 1 4.232 0.04 . 2 . . . . 76 GLY HA2 . 17532 1 542 . 1 1 76 76 GLY HA3 H 1 3.734 0.04 . 2 . . . . 76 GLY HA3 . 17532 1 543 . 1 1 76 76 GLY C C 13 172.881 0.2 . 1 . . . . 76 GLY C . 17532 1 544 . 1 1 76 76 GLY CA C 13 45.740 0.2 . 1 . . . . 76 GLY CA . 17532 1 545 . 1 1 76 76 GLY N N 15 104.615 0.2 . 1 . . . . 76 GLY N . 17532 1 546 . 1 1 77 77 HIS H H 1 7.496 0.04 . 1 . . . . 77 HIS H . 17532 1 547 . 1 1 77 77 HIS HA H 1 5.204 0.04 . 1 . . . . 77 HIS HA . 17532 1 548 . 1 1 77 77 HIS HB2 H 1 2.936 0.04 . 2 . . . . 77 HIS HB2 . 17532 1 549 . 1 1 77 77 HIS HB3 H 1 3.159 0.04 . 2 . . . . 77 HIS HB3 . 17532 1 550 . 1 1 77 77 HIS C C 13 172.514 0.2 . 1 . . . . 77 HIS C . 17532 1 551 . 1 1 77 77 HIS CA C 13 53.910 0.2 . 1 . . . . 77 HIS CA . 17532 1 552 . 1 1 77 77 HIS CB C 13 32.248 0.2 . 1 . . . . 77 HIS CB . 17532 1 553 . 1 1 77 77 HIS N N 15 117.092 0.2 . 1 . . . . 77 HIS N . 17532 1 554 . 1 1 78 78 VAL H H 1 8.889 0.04 . 1 . . . . 78 VAL H . 17532 1 555 . 1 1 78 78 VAL HA H 1 5.036 0.04 . 1 . . . . 78 VAL HA . 17532 1 556 . 1 1 78 78 VAL HB H 1 2.438 0.04 . 1 . . . . 78 VAL HB . 17532 1 557 . 1 1 78 78 VAL HG11 H 1 1.157 0.04 . 1 . . . . 78 VAL HG11 . 17532 1 558 . 1 1 78 78 VAL HG12 H 1 1.157 0.04 . 1 . . . . 78 VAL HG12 . 17532 1 559 . 1 1 78 78 VAL HG13 H 1 1.157 0.04 . 1 . . . . 78 VAL HG13 . 17532 1 560 . 1 1 78 78 VAL HG21 H 1 1.032 0.04 . 1 . . . . 78 VAL HG21 . 17532 1 561 . 1 1 78 78 VAL HG22 H 1 1.032 0.04 . 1 . . . . 78 VAL HG22 . 17532 1 562 . 1 1 78 78 VAL HG23 H 1 1.032 0.04 . 1 . . . . 78 VAL HG23 . 17532 1 563 . 1 1 78 78 VAL C C 13 175.349 0.2 . 1 . . . . 78 VAL C . 17532 1 564 . 1 1 78 78 VAL CA C 13 60.494 0.2 . 1 . . . . 78 VAL CA . 17532 1 565 . 1 1 78 78 VAL CB C 13 34.753 0.2 . 1 . . . . 78 VAL CB . 17532 1 566 . 1 1 78 78 VAL CG1 C 13 22.75 0.2 . 1 . . . . 78 VAL CG1 . 17532 1 567 . 1 1 78 78 VAL CG2 C 13 21.07 0.2 . 1 . . . . 78 VAL CG2 . 17532 1 568 . 1 1 78 78 VAL N N 15 115.571 0.2 . 1 . . . . 78 VAL N . 17532 1 569 . 1 1 79 79 ASP H H 1 9.188 0.04 . 1 . . . . 79 ASP H . 17532 1 570 . 1 1 79 79 ASP HA H 1 5.506 0.04 . 1 . . . . 79 ASP HA . 17532 1 571 . 1 1 79 79 ASP HB2 H 1 2.508 0.04 . 2 . . . . 79 ASP HB2 . 17532 1 572 . 1 1 79 79 ASP HB3 H 1 3.006 0.04 . 2 . . . . 79 ASP HB3 . 17532 1 573 . 1 1 79 79 ASP C C 13 176.400 0.2 . 1 . . . . 79 ASP C . 17532 1 574 . 1 1 79 79 ASP CA C 13 51.767 0.2 . 1 . . . . 79 ASP CA . 17532 1 575 . 1 1 79 79 ASP CB C 13 41.112 0.2 . 1 . . . . 79 ASP CB . 17532 1 576 . 1 1 79 79 ASP N N 15 126.427 0.2 . 1 . . . . 79 ASP N . 17532 1 577 . 1 1 80 80 PHE H H 1 8.472 0.04 . 1 . . . . 80 PHE H . 17532 1 578 . 1 1 80 80 PHE HA H 1 3.350 0.04 . 1 . . . . 80 PHE HA . 17532 1 579 . 1 1 80 80 PHE HB2 H 1 2.486 0.04 . 2 . . . . 80 PHE HB2 . 17532 1 580 . 1 1 80 80 PHE HB3 H 1 2.131 0.04 . 2 . . . . 80 PHE HB3 . 17532 1 581 . 1 1 80 80 PHE HD1 H 1 6.693 0.04 . 3 . . . . 80 PHE HD1 . 17532 1 582 . 1 1 80 80 PHE HD2 H 1 6.693 0.04 . 3 . . . . 80 PHE HD2 . 17532 1 583 . 1 1 80 80 PHE HE1 H 1 7.063 0.04 . 3 . . . . 80 PHE HE1 . 17532 1 584 . 1 1 80 80 PHE HE2 H 1 7.063 0.04 . 3 . . . . 80 PHE HE2 . 17532 1 585 . 1 1 80 80 PHE HZ H 1 7.217 0.04 . 1 . . . . 80 PHE HZ . 17532 1 586 . 1 1 80 80 PHE C C 13 176.411 0.2 . 1 . . . . 80 PHE C . 17532 1 587 . 1 1 80 80 PHE CA C 13 62.142 0.2 . 1 . . . . 80 PHE CA . 17532 1 588 . 1 1 80 80 PHE CB C 13 38.557 0.2 . 1 . . . . 80 PHE CB . 17532 1 589 . 1 1 80 80 PHE N N 15 118.573 0.2 . 1 . . . . 80 PHE N . 17532 1 590 . 1 1 81 81 ASP H H 1 7.697 0.04 . 1 . . . . 81 ASP H . 17532 1 591 . 1 1 81 81 ASP HA H 1 4.048 0.04 . 1 . . . . 81 ASP HA . 17532 1 592 . 1 1 81 81 ASP HB2 H 1 2.593 0.04 . 2 . . . . 81 ASP HB2 . 17532 1 593 . 1 1 81 81 ASP HB3 H 1 2.740 0.04 . 2 . . . . 81 ASP HB3 . 17532 1 594 . 1 1 81 81 ASP C C 13 179.520 0.2 . 1 . . . . 81 ASP C . 17532 1 595 . 1 1 81 81 ASP CA C 13 57.661 0.2 . 1 . . . . 81 ASP CA . 17532 1 596 . 1 1 81 81 ASP CB C 13 40.051 0.2 . 1 . . . . 81 ASP CB . 17532 1 597 . 1 1 81 81 ASP N N 15 117.736 0.2 . 1 . . . . 81 ASP N . 17532 1 598 . 1 1 82 82 ASP H H 1 8.552 0.04 . 1 . . . . 82 ASP H . 17532 1 599 . 1 1 82 82 ASP HA H 1 4.382 0.04 . 1 . . . . 82 ASP HA . 17532 1 600 . 1 1 82 82 ASP HB2 H 1 2.977 0.04 . 2 . . . . 82 ASP HB2 . 17532 1 601 . 1 1 82 82 ASP HB3 H 1 2.593 0.04 . 2 . . . . 82 ASP HB3 . 17532 1 602 . 1 1 82 82 ASP C C 13 178.307 0.2 . 1 . . . . 82 ASP C . 17532 1 603 . 1 1 82 82 ASP CA C 13 57.299 0.2 . 1 . . . . 82 ASP CA . 17532 1 604 . 1 1 82 82 ASP CB C 13 41.123 0.2 . 1 . . . . 82 ASP CB . 17532 1 605 . 1 1 82 82 ASP N N 15 121.901 0.2 . 1 . . . . 82 ASP N . 17532 1 606 . 1 1 83 83 PHE H H 1 8.555 0.04 . 1 . . . . 83 PHE H . 17532 1 607 . 1 1 83 83 PHE HA H 1 4.104 0.04 . 1 . . . . 83 PHE HA . 17532 1 608 . 1 1 83 83 PHE HB2 H 1 3.406 0.04 . 2 . . . . 83 PHE HB2 . 17532 1 609 . 1 1 83 83 PHE HB3 H 1 3.192 0.04 . 2 . . . . 83 PHE HB3 . 17532 1 610 . 1 1 83 83 PHE HD1 H 1 7.090 0.04 . 3 . . . . 83 PHE HD1 . 17532 1 611 . 1 1 83 83 PHE HD2 H 1 7.090 0.04 . 3 . . . . 83 PHE HD2 . 17532 1 612 . 1 1 83 83 PHE HE1 H 1 7.473 0.04 . 3 . . . . 83 PHE HE1 . 17532 1 613 . 1 1 83 83 PHE HE2 H 1 7.473 0.04 . 3 . . . . 83 PHE HE2 . 17532 1 614 . 1 1 83 83 PHE HZ H 1 7.290 0.04 . 1 . . . . 83 PHE HZ . 17532 1 615 . 1 1 83 83 PHE C C 13 176.688 0.2 . 1 . . . . 83 PHE C . 17532 1 616 . 1 1 83 83 PHE CA C 13 61.154 0.2 . 1 . . . . 83 PHE CA . 17532 1 617 . 1 1 83 83 PHE CB C 13 39.758 0.2 . 1 . . . . 83 PHE CB . 17532 1 618 . 1 1 83 83 PHE N N 15 122.051 0.2 . 1 . . . . 83 PHE N . 17532 1 619 . 1 1 84 84 VAL H H 1 8.255 0.04 . 1 . . . . 84 VAL H . 17532 1 620 . 1 1 84 84 VAL HA H 1 2.986 0.04 . 1 . . . . 84 VAL HA . 17532 1 621 . 1 1 84 84 VAL HB H 1 1.812 0.04 . 1 . . . . 84 VAL HB . 17532 1 622 . 1 1 84 84 VAL HG11 H 1 0.684 0.04 . 1 . . . . 84 VAL HG11 . 17532 1 623 . 1 1 84 84 VAL HG12 H 1 0.684 0.04 . 1 . . . . 84 VAL HG12 . 17532 1 624 . 1 1 84 84 VAL HG13 H 1 0.684 0.04 . 1 . . . . 84 VAL HG13 . 17532 1 625 . 1 1 84 84 VAL HG21 H 1 0.334 0.04 . 1 . . . . 84 VAL HG21 . 17532 1 626 . 1 1 84 84 VAL HG22 H 1 0.334 0.04 . 1 . . . . 84 VAL HG22 . 17532 1 627 . 1 1 84 84 VAL HG23 H 1 0.334 0.04 . 1 . . . . 84 VAL HG23 . 17532 1 628 . 1 1 84 84 VAL C C 13 178.681 0.2 . 1 . . . . 84 VAL C . 17532 1 629 . 1 1 84 84 VAL CA C 13 67.086 0.2 . 1 . . . . 84 VAL CA . 17532 1 630 . 1 1 84 84 VAL CB C 13 31.555 0.2 . 1 . . . . 84 VAL CB . 17532 1 631 . 1 1 84 84 VAL CG1 C 13 21.390 0.2 . 1 . . . . 84 VAL CG1 . 17532 1 632 . 1 1 84 84 VAL CG2 C 13 24.060 0.2 . 1 . . . . 84 VAL CG2 . 17532 1 633 . 1 1 84 84 VAL N N 15 119.936 0.2 . 1 . . . . 84 VAL N . 17532 1 634 . 1 1 85 85 GLU H H 1 7.579 0.04 . 1 . . . . 85 GLU H . 17532 1 635 . 1 1 85 85 GLU HA H 1 3.952 0.04 . 1 . . . . 85 GLU HA . 17532 1 636 . 1 1 85 85 GLU HB2 H 1 2.140 0.04 . 2 . . . . 85 GLU HB2 . 17532 1 637 . 1 1 85 85 GLU C C 13 178.419 0.2 . 1 . . . . 85 GLU C . 17532 1 638 . 1 1 85 85 GLU CA C 13 59.161 0.2 . 1 . . . . 85 GLU CA . 17532 1 639 . 1 1 85 85 GLU CB C 13 29.486 0.2 . 1 . . . . 85 GLU CB . 17532 1 640 . 1 1 85 85 GLU N N 15 120.098 0.2 . 1 . . . . 85 GLU N . 17532 1 641 . 1 1 86 86 LEU H H 1 7.823 0.04 . 1 . . . . 86 LEU H . 17532 1 642 . 1 1 86 86 LEU HA H 1 4.142 0.04 . 1 . . . . 86 LEU HA . 17532 1 643 . 1 1 86 86 LEU HB2 H 1 1.743 0.04 . 2 . . . . 86 LEU HB2 . 17532 1 644 . 1 1 86 86 LEU HB3 H 1 1.389 0.04 . 2 . . . . 86 LEU HB3 . 17532 1 645 . 1 1 86 86 LEU HG H 1 1.818 0.04 . 1 . . . . 86 LEU HG . 17532 1 646 . 1 1 86 86 LEU HD11 H 1 0.816 0.04 . 1 . . . . 86 LEU HD11 . 17532 1 647 . 1 1 86 86 LEU HD12 H 1 0.816 0.04 . 1 . . . . 86 LEU HD12 . 17532 1 648 . 1 1 86 86 LEU HD13 H 1 0.816 0.04 . 1 . . . . 86 LEU HD13 . 17532 1 649 . 1 1 86 86 LEU HD21 H 1 0.852 0.04 . 1 . . . . 86 LEU HD21 . 17532 1 650 . 1 1 86 86 LEU HD22 H 1 0.852 0.04 . 1 . . . . 86 LEU HD22 . 17532 1 651 . 1 1 86 86 LEU HD23 H 1 0.852 0.04 . 1 . . . . 86 LEU HD23 . 17532 1 652 . 1 1 86 86 LEU C C 13 178.465 0.2 . 1 . . . . 86 LEU C . 17532 1 653 . 1 1 86 86 LEU CA C 13 56.959 0.2 . 1 . . . . 86 LEU CA . 17532 1 654 . 1 1 86 86 LEU CB C 13 43.038 0.2 . 1 . . . . 86 LEU CB . 17532 1 655 . 1 1 86 86 LEU CG C 13 26.780 0.2 . 1 . . . . 86 LEU CG . 17532 1 656 . 1 1 86 86 LEU CD1 C 13 25.670 0.2 . 1 . . . . 86 LEU CD1 . 17532 1 657 . 1 1 86 86 LEU CD2 C 13 24.200 0.2 . 1 . . . . 86 LEU CD2 . 17532 1 658 . 1 1 86 86 LEU N N 15 117.340 0.2 . 1 . . . . 86 LEU N . 17532 1 659 . 1 1 87 87 MET H H 1 8.196 0.04 . 1 . . . . 87 MET H . 17532 1 660 . 1 1 87 87 MET HA H 1 4.348 0.04 . 1 . . . . 87 MET HA . 17532 1 661 . 1 1 87 87 MET HB2 H 1 1.524 0.04 . 2 . . . . 87 MET HB2 . 17532 1 662 . 1 1 87 87 MET HB3 H 1 1.447 0.04 . 2 . . . . 87 MET HB3 . 17532 1 663 . 1 1 87 87 MET C C 13 178.592 0.2 . 1 . . . . 87 MET C . 17532 1 664 . 1 1 87 87 MET CA C 13 54.447 0.2 . 1 . . . . 87 MET CA . 17532 1 665 . 1 1 87 87 MET CB C 13 32.065 0.2 . 1 . . . . 87 MET CB . 17532 1 666 . 1 1 87 87 MET N N 15 114.402 0.2 . 1 . . . . 87 MET N . 17532 1 667 . 1 1 88 88 GLY H H 1 8.296 0.04 . 1 . . . . 88 GLY H . 17532 1 668 . 1 1 88 88 GLY HA2 H 1 4.195 0.04 . 2 . . . . 88 GLY HA2 . 17532 1 669 . 1 1 88 88 GLY HA3 H 1 3.616 0.04 . 2 . . . . 88 GLY HA3 . 17532 1 670 . 1 1 88 88 GLY CA C 13 49.091 0.2 . 1 . . . . 88 GLY CA . 17532 1 671 . 1 1 88 88 GLY N N 15 108.218 0.2 . 1 . . . . 88 GLY N . 17532 1 672 . 1 1 89 89 PRO HA H 1 4.209 0.04 . 1 . . . . 89 PRO HA . 17532 1 673 . 1 1 89 89 PRO HB2 H 1 2.421 0.04 . 2 . . . . 89 PRO HB2 . 17532 1 674 . 1 1 89 89 PRO HB3 H 1 1.842 0.04 . 2 . . . . 89 PRO HB3 . 17532 1 675 . 1 1 89 89 PRO C C 13 178.721 0.2 . 1 . . . . 89 PRO C . 17532 1 676 . 1 1 89 89 PRO CA C 13 65.110 0.2 . 1 . . . . 89 PRO CA . 17532 1 677 . 1 1 89 89 PRO CB C 13 32.220 0.2 . 1 . . . . 89 PRO CB . 17532 1 678 . 1 1 90 90 LYS H H 1 7.043 0.04 . 1 . . . . 90 LYS H . 17532 1 679 . 1 1 90 90 LYS HA H 1 4.029 0.04 . 1 . . . . 90 LYS HA . 17532 1 680 . 1 1 90 90 LYS C C 13 178.018 0.2 . 1 . . . . 90 LYS C . 17532 1 681 . 1 1 90 90 LYS CA C 13 57.619 0.2 . 1 . . . . 90 LYS CA . 17532 1 682 . 1 1 90 90 LYS CB C 13 31.758 0.2 . 1 . . . . 90 LYS CB . 17532 1 683 . 1 1 90 90 LYS N N 15 114.717 0.2 . 1 . . . . 90 LYS N . 17532 1 684 . 1 1 91 91 LEU H H 1 7.687 0.04 . 1 . . . . 91 LEU H . 17532 1 685 . 1 1 91 91 LEU HA H 1 4.121 0.04 . 1 . . . . 91 LEU HA . 17532 1 686 . 1 1 91 91 LEU HB2 H 1 1.611 0.04 . 2 . . . . 91 LEU HB2 . 17532 1 687 . 1 1 91 91 LEU C C 13 179.155 0.2 . 1 . . . . 91 LEU C . 17532 1 688 . 1 1 91 91 LEU CA C 13 57.228 0.2 . 1 . . . . 91 LEU CA . 17532 1 689 . 1 1 91 91 LEU CB C 13 41.790 0.2 . 1 . . . . 91 LEU CB . 17532 1 690 . 1 1 91 91 LEU N N 15 119.101 0.2 . 1 . . . . 91 LEU N . 17532 1 691 . 1 1 92 92 LEU H H 1 7.837 0.04 . 1 . . . . 92 LEU H . 17532 1 692 . 1 1 92 92 LEU HA H 1 4.199 0.04 . 1 . . . . 92 LEU HA . 17532 1 693 . 1 1 92 92 LEU HB2 H 1 1.652 0.04 . 2 . . . . 92 LEU HB2 . 17532 1 694 . 1 1 92 92 LEU HB3 H 1 1.510 0.04 . 2 . . . . 92 LEU HB3 . 17532 1 695 . 1 1 92 92 LEU HG H 1 1.668 0.04 . 1 . . . . 92 LEU HG . 17532 1 696 . 1 1 92 92 LEU HD11 H 1 0.754 0.04 . 1 . . . . 92 LEU HD11 . 17532 1 697 . 1 1 92 92 LEU HD12 H 1 0.754 0.04 . 1 . . . . 92 LEU HD12 . 17532 1 698 . 1 1 92 92 LEU HD13 H 1 0.754 0.04 . 1 . . . . 92 LEU HD13 . 17532 1 699 . 1 1 92 92 LEU HD21 H 1 0.748 0.04 . 1 . . . . 92 LEU HD21 . 17532 1 700 . 1 1 92 92 LEU HD22 H 1 0.748 0.04 . 1 . . . . 92 LEU HD22 . 17532 1 701 . 1 1 92 92 LEU HD23 H 1 0.748 0.04 . 1 . . . . 92 LEU HD23 . 17532 1 702 . 1 1 92 92 LEU C C 13 177.405 0.2 . 1 . . . . 92 LEU C . 17532 1 703 . 1 1 92 92 LEU CA C 13 55.906 0.2 . 1 . . . . 92 LEU CA . 17532 1 704 . 1 1 92 92 LEU CB C 13 41.937 0.2 . 1 . . . . 92 LEU CB . 17532 1 705 . 1 1 92 92 LEU CD1 C 13 25.270 0.2 . 1 . . . . 92 LEU CD1 . 17532 1 706 . 1 1 92 92 LEU CD2 C 13 22.990 0.2 . 1 . . . . 92 LEU CD2 . 17532 1 707 . 1 1 92 92 LEU N N 15 117.988 0.2 . 1 . . . . 92 LEU N . 17532 1 708 . 1 1 93 93 ALA H H 1 7.429 0.04 . 1 . . . . 93 ALA H . 17532 1 709 . 1 1 93 93 ALA HA H 1 4.282 0.04 . 1 . . . . 93 ALA HA . 17532 1 710 . 1 1 93 93 ALA HB1 H 1 1.515 0.04 . 1 . . . . 93 ALA HB1 . 17532 1 711 . 1 1 93 93 ALA HB2 H 1 1.515 0.04 . 1 . . . . 93 ALA HB2 . 17532 1 712 . 1 1 93 93 ALA HB3 H 1 1.515 0.04 . 1 . . . . 93 ALA HB3 . 17532 1 713 . 1 1 93 93 ALA C C 13 177.400 0.2 . 1 . . . . 93 ALA C . 17532 1 714 . 1 1 93 93 ALA CA C 13 53.285 0.2 . 1 . . . . 93 ALA CA . 17532 1 715 . 1 1 93 93 ALA CB C 13 19.251 0.2 . 1 . . . . 93 ALA CB . 17532 1 716 . 1 1 93 93 ALA N N 15 121.849 0.2 . 1 . . . . 93 ALA N . 17532 1 717 . 1 1 94 94 GLU H H 1 8.127 0.04 . 1 . . . . 94 GLU H . 17532 1 718 . 1 1 94 94 GLU HA H 1 4.423 0.04 . 1 . . . . 94 GLU HA . 17532 1 719 . 1 1 94 94 GLU HB2 H 1 2.162 0.04 . 2 . . . . 94 GLU HB2 . 17532 1 720 . 1 1 94 94 GLU C C 13 176.900 0.2 . 1 . . . . 94 GLU C . 17532 1 721 . 1 1 94 94 GLU CA C 13 57.100 0.2 . 1 . . . . 94 GLU CA . 17532 1 722 . 1 1 94 94 GLU CB C 13 30.150 0.2 . 1 . . . . 94 GLU CB . 17532 1 723 . 1 1 94 94 GLU N N 15 118.932 0.2 . 1 . . . . 94 GLU N . 17532 1 724 . 1 1 95 95 THR H H 1 7.930 0.04 . 1 . . . . 95 THR H . 17532 1 725 . 1 1 95 95 THR HA H 1 4.417 0.04 . 1 . . . . 95 THR HA . 17532 1 726 . 1 1 95 95 THR HB H 1 4.352 0.04 . 1 . . . . 95 THR HB . 17532 1 727 . 1 1 95 95 THR HG21 H 1 1.280 0.04 . 1 . . . . 95 THR HG21 . 17532 1 728 . 1 1 95 95 THR HG22 H 1 1.280 0.04 . 1 . . . . 95 THR HG22 . 17532 1 729 . 1 1 95 95 THR HG23 H 1 1.280 0.04 . 1 . . . . 95 THR HG23 . 17532 1 730 . 1 1 95 95 THR C C 13 174.663 0.2 . 1 . . . . 95 THR C . 17532 1 731 . 1 1 95 95 THR CA C 13 61.848 0.2 . 1 . . . . 95 THR CA . 17532 1 732 . 1 1 95 95 THR CB C 13 70.110 0.2 . 1 . . . . 95 THR CB . 17532 1 733 . 1 1 95 95 THR CG2 C 13 21.830 0.2 . 1 . . . . 95 THR CG2 . 17532 1 734 . 1 1 95 95 THR N N 15 113.151 0.2 . 1 . . . . 95 THR N . 17532 1 735 . 1 1 96 96 ALA H H 1 8.216 0.04 . 1 . . . . 96 ALA H . 17532 1 736 . 1 1 96 96 ALA HA H 1 4.305 0.04 . 1 . . . . 96 ALA HA . 17532 1 737 . 1 1 96 96 ALA HB1 H 1 1.444 0.04 . 1 . . . . 96 ALA HB1 . 17532 1 738 . 1 1 96 96 ALA HB2 H 1 1.444 0.04 . 1 . . . . 96 ALA HB2 . 17532 1 739 . 1 1 96 96 ALA HB3 H 1 1.444 0.04 . 1 . . . . 96 ALA HB3 . 17532 1 740 . 1 1 96 96 ALA C C 13 177.477 0.2 . 1 . . . . 96 ALA C . 17532 1 741 . 1 1 96 96 ALA CA C 13 53.206 0.2 . 1 . . . . 96 ALA CA . 17532 1 742 . 1 1 96 96 ALA CB C 13 19.436 0.2 . 1 . . . . 96 ALA CB . 17532 1 743 . 1 1 96 96 ALA N N 15 125.432 0.2 . 1 . . . . 96 ALA N . 17532 1 744 . 1 1 97 97 ASP H H 1 8.211 0.04 . 1 . . . . 97 ASP H . 17532 1 745 . 1 1 97 97 ASP C C 13 176.233 0.2 . 1 . . . . 97 ASP C . 17532 1 746 . 1 1 97 97 ASP CA C 13 54.743 0.2 . 1 . . . . 97 ASP CA . 17532 1 747 . 1 1 97 97 ASP CB C 13 41.246 0.2 . 1 . . . . 97 ASP CB . 17532 1 748 . 1 1 97 97 ASP N N 15 118.477 0.2 . 1 . . . . 97 ASP N . 17532 1 749 . 1 1 98 98 MET H H 1 8.106 0.04 . 1 . . . . 98 MET H . 17532 1 750 . 1 1 98 98 MET HA H 1 4.495 0.04 . 1 . . . A 98 MET HA . 17532 1 751 . 1 1 98 98 MET HB2 H 1 2.099 0.04 . 2 . . . A 98 MET HB2 . 17532 1 752 . 1 1 98 98 MET C C 13 176.197 0.2 . 1 . . . A 98 MET C . 17532 1 753 . 1 1 98 98 MET CA C 13 55.984 0.2 . 1 . . . A 98 MET CA . 17532 1 754 . 1 1 98 98 MET CB C 13 33.021 0.2 . 1 . . . A 98 MET CB . 17532 1 755 . 1 1 98 98 MET N N 15 119.877 0.2 . 1 . . . A 98 MET N . 17532 1 756 . 1 1 99 99 ILE H H 1 8.045 0.04 . 1 . . . A 99 ILE H . 17532 1 757 . 1 1 99 99 ILE HA H 1 4.164 0.04 . 1 . . . A 99 ILE HA . 17532 1 758 . 1 1 99 99 ILE HB H 1 1.912 0.04 . 1 . . . A 99 ILE HB . 17532 1 759 . 1 1 99 99 ILE HG12 H 1 1.583 0.04 . 2 . . . A 99 ILE HG12 . 17532 1 760 . 1 1 99 99 ILE HG13 H 1 1.264 0.04 . 2 . . . A 99 ILE HG13 . 17532 1 761 . 1 1 99 99 ILE HG21 H 1 0.985 0.04 . 1 . . . A 99 ILE HG21 . 17532 1 762 . 1 1 99 99 ILE HG22 H 1 0.985 0.04 . 1 . . . A 99 ILE HG22 . 17532 1 763 . 1 1 99 99 ILE HG23 H 1 0.985 0.04 . 1 . . . A 99 ILE HG23 . 17532 1 764 . 1 1 99 99 ILE HD11 H 1 0.878 0.04 . 1 . . . A 99 ILE HD11 . 17532 1 765 . 1 1 99 99 ILE HD12 H 1 0.878 0.04 . 1 . . . A 99 ILE HD12 . 17532 1 766 . 1 1 99 99 ILE HD13 H 1 0.878 0.04 . 1 . . . A 99 ILE HD13 . 17532 1 767 . 1 1 99 99 ILE C C 13 175.982 0.2 . 1 . . . A 99 ILE C . 17532 1 768 . 1 1 99 99 ILE CA C 13 61.700 0.2 . 1 . . . A 99 ILE CA . 17532 1 769 . 1 1 99 99 ILE CB C 13 38.572 0.2 . 1 . . . A 99 ILE CB . 17532 1 770 . 1 1 99 99 ILE CG1 C 13 27.640 0.2 . 1 . . . A 99 ILE CG1 . 17532 1 771 . 1 1 99 99 ILE CG2 C 13 17.800 0.2 . 1 . . . A 99 ILE CG2 . 17532 1 772 . 1 1 99 99 ILE CD1 C 13 13.330 0.2 . 1 . . . A 99 ILE CD1 . 17532 1 773 . 1 1 99 99 ILE N N 15 121.235 0.2 . 1 . . . A 99 ILE N . 17532 1 774 . 1 1 100 100 GLY H H 1 8.467 0.04 . 1 . . . A 100 GLY H . 17532 1 775 . 1 1 100 100 GLY HA2 H 1 4.262 0.04 . 2 . . . A 100 GLY HA2 . 17532 1 776 . 1 1 100 100 GLY HA3 H 1 4.039 0.04 . 2 . . . A 100 GLY HA3 . 17532 1 777 . 1 1 100 100 GLY C C 13 174.458 0.2 . 1 . . . A 100 GLY C . 17532 1 778 . 1 1 100 100 GLY CA C 13 45.249 0.2 . 1 . . . A 100 GLY CA . 17532 1 779 . 1 1 100 100 GLY N N 15 112.837 0.2 . 1 . . . A 100 GLY N . 17532 1 780 . 1 1 101 101 VAL H H 1 8.180 0.04 . 1 . . . A 101 VAL H . 17532 1 781 . 1 1 101 101 VAL HA H 1 3.944 0.04 . 1 . . . A 101 VAL HA . 17532 1 782 . 1 1 101 101 VAL HB H 1 2.209 0.04 . 1 . . . A 101 VAL HB . 17532 1 783 . 1 1 101 101 VAL HG11 H 1 1.082 0.04 . 1 . . . A 101 VAL HG11 . 17532 1 784 . 1 1 101 101 VAL HG12 H 1 1.082 0.04 . 1 . . . A 101 VAL HG12 . 17532 1 785 . 1 1 101 101 VAL HG13 H 1 1.082 0.04 . 1 . . . A 101 VAL HG13 . 17532 1 786 . 1 1 101 101 VAL HG21 H 1 1.151 0.04 . 1 . . . A 101 VAL HG21 . 17532 1 787 . 1 1 101 101 VAL HG22 H 1 1.151 0.04 . 1 . . . A 101 VAL HG22 . 17532 1 788 . 1 1 101 101 VAL HG23 H 1 1.151 0.04 . 1 . . . A 101 VAL HG23 . 17532 1 789 . 1 1 101 101 VAL C C 13 177.290 0.2 . 1 . . . A 101 VAL C . 17532 1 790 . 1 1 101 101 VAL CA C 13 65.721 0.2 . 1 . . . A 101 VAL CA . 17532 1 791 . 1 1 101 101 VAL CB C 13 32.001 0.2 . 1 . . . A 101 VAL CB . 17532 1 792 . 1 1 101 101 VAL CG1 C 13 21.150 0.2 . 1 . . . A 101 VAL CG1 . 17532 1 793 . 1 1 101 101 VAL CG2 C 13 22.030 0.2 . 1 . . . A 101 VAL CG2 . 17532 1 794 . 1 1 101 101 VAL N N 15 119.763 0.2 . 1 . . . A 101 VAL N . 17532 1 795 . 1 1 102 102 LYS H H 1 8.371 0.04 . 1 . . . A 102 LYS H . 17532 1 796 . 1 1 102 102 LYS HA H 1 4.018 0.04 . 1 . . . A 102 LYS HA . 17532 1 797 . 1 1 102 102 LYS HB2 H 1 1.902 0.04 . 2 . . . A 102 LYS HB2 . 17532 1 798 . 1 1 102 102 LYS C C 13 178.292 0.2 . 1 . . . A 102 LYS C . 17532 1 799 . 1 1 102 102 LYS CA C 13 59.780 0.2 . 1 . . . A 102 LYS CA . 17532 1 800 . 1 1 102 102 LYS CB C 13 32.459 0.2 . 1 . . . A 102 LYS CB . 17532 1 801 . 1 1 102 102 LYS N N 15 121.994 0.2 . 1 . . . A 102 LYS N . 17532 1 802 . 1 1 103 103 GLU H H 1 8.311 0.04 . 1 . . . A 103 GLU H . 17532 1 803 . 1 1 103 103 GLU HA H 1 4.243 0.04 . 1 . . . A 103 GLU HA . 17532 1 804 . 1 1 103 103 GLU HB2 H 1 2.354 0.04 . 2 . . . A 103 GLU HB2 . 17532 1 805 . 1 1 103 103 GLU HB3 H 1 2.096 0.04 . 2 . . . A 103 GLU HB3 . 17532 1 806 . 1 1 103 103 GLU C C 13 179.983 0.2 . 1 . . . A 103 GLU C . 17532 1 807 . 1 1 103 103 GLU CA C 13 59.947 0.2 . 1 . . . A 103 GLU CA . 17532 1 808 . 1 1 103 103 GLU CB C 13 29.194 0.2 . 1 . . . A 103 GLU CB . 17532 1 809 . 1 1 103 103 GLU N N 15 119.064 0.2 . 1 . . . A 103 GLU N . 17532 1 810 . 1 1 104 104 LEU H H 1 8.314 0.04 . 1 . . . A 104 LEU H . 17532 1 811 . 1 1 104 104 LEU HA H 1 4.340 0.04 . 1 . . . A 104 LEU HA . 17532 1 812 . 1 1 104 104 LEU HB2 H 1 2.257 0.04 . 2 . . . A 104 LEU HB2 . 17532 1 813 . 1 1 104 104 LEU HB3 H 1 1.685 0.04 . 2 . . . A 104 LEU HB3 . 17532 1 814 . 1 1 104 104 LEU C C 13 179.074 0.2 . 1 . . . A 104 LEU C . 17532 1 815 . 1 1 104 104 LEU CA C 13 58.346 0.2 . 1 . . . A 104 LEU CA . 17532 1 816 . 1 1 104 104 LEU CB C 13 42.350 0.2 . 1 . . . A 104 LEU CB . 17532 1 817 . 1 1 104 104 LEU N N 15 121.269 0.2 . 1 . . . A 104 LEU N . 17532 1 818 . 1 1 105 105 ARG H H 1 8.702 0.04 . 1 . . . A 105 ARG H . 17532 1 819 . 1 1 105 105 ARG HA H 1 4.029 0.04 . 1 . . . A 105 ARG HA . 17532 1 820 . 1 1 105 105 ARG HB2 H 1 2.706 0.04 . 2 . . . A 105 ARG HB2 . 17532 1 821 . 1 1 105 105 ARG HB3 H 1 1.902 0.04 . 2 . . . A 105 ARG HB3 . 17532 1 822 . 1 1 105 105 ARG C C 13 178.887 0.2 . 1 . . . A 105 ARG C . 17532 1 823 . 1 1 105 105 ARG CA C 13 59.688 0.2 . 1 . . . A 105 ARG CA . 17532 1 824 . 1 1 105 105 ARG CB C 13 29.392 0.2 . 1 . . . A 105 ARG CB . 17532 1 825 . 1 1 105 105 ARG N N 15 120.637 0.2 . 1 . . . A 105 ARG N . 17532 1 826 . 1 1 106 106 ASP H H 1 8.085 0.04 . 1 . . . A 106 ASP H . 17532 1 827 . 1 1 106 106 ASP HA H 1 4.444 0.04 . 1 . . . A 106 ASP HA . 17532 1 828 . 1 1 106 106 ASP HB2 H 1 2.808 0.04 . 2 . . . A 106 ASP HB2 . 17532 1 829 . 1 1 106 106 ASP HB3 H 1 2.736 0.04 . 2 . . . A 106 ASP HB3 . 17532 1 830 . 1 1 106 106 ASP C C 13 178.650 0.2 . 1 . . . A 106 ASP C . 17532 1 831 . 1 1 106 106 ASP CA C 13 57.486 0.2 . 1 . . . A 106 ASP CA . 17532 1 832 . 1 1 106 106 ASP CB C 13 40.150 0.2 . 1 . . . A 106 ASP CB . 17532 1 833 . 1 1 106 106 ASP N N 15 120.040 0.2 . 1 . . . A 106 ASP N . 17532 1 834 . 1 1 107 107 ALA H H 1 7.962 0.04 . 1 . . . A 107 ALA H . 17532 1 835 . 1 1 107 107 ALA HA H 1 4.127 0.04 . 1 . . . A 107 ALA HA . 17532 1 836 . 1 1 107 107 ALA HB1 H 1 1.669 0.04 . 1 . . . A 107 ALA HB1 . 17532 1 837 . 1 1 107 107 ALA HB2 H 1 1.669 0.04 . 1 . . . A 107 ALA HB2 . 17532 1 838 . 1 1 107 107 ALA HB3 H 1 1.669 0.04 . 1 . . . A 107 ALA HB3 . 17532 1 839 . 1 1 107 107 ALA C C 13 178.387 0.2 . 1 . . . A 107 ALA C . 17532 1 840 . 1 1 107 107 ALA CA C 13 54.965 0.2 . 1 . . . A 107 ALA CA . 17532 1 841 . 1 1 107 107 ALA CB C 13 18.229 0.2 . 1 . . . A 107 ALA CB . 17532 1 842 . 1 1 107 107 ALA N N 15 122.925 0.2 . 1 . . . A 107 ALA N . 17532 1 843 . 1 1 108 108 PHE H H 1 8.392 0.04 . 1 . . . A 108 PHE H . 17532 1 844 . 1 1 108 108 PHE HA H 1 3.089 0.04 . 1 . . . A 108 PHE HA . 17532 1 845 . 1 1 108 108 PHE HB2 H 1 3.174 0.04 . 2 . . . A 108 PHE HB2 . 17532 1 846 . 1 1 108 108 PHE HB3 H 1 2.910 0.04 . 2 . . . A 108 PHE HB3 . 17532 1 847 . 1 1 108 108 PHE HD1 H 1 6.595 0.04 . 3 . . . A 108 PHE HD1 . 17532 1 848 . 1 1 108 108 PHE HD2 H 1 6.595 0.04 . 3 . . . A 108 PHE HD2 . 17532 1 849 . 1 1 108 108 PHE HE1 H 1 7.060 0.04 . 3 . . . A 108 PHE HE1 . 17532 1 850 . 1 1 108 108 PHE HE2 H 1 7.060 0.04 . 3 . . . A 108 PHE HE2 . 17532 1 851 . 1 1 108 108 PHE HZ H 1 7.386 0.04 . 1 . . . A 108 PHE HZ . 17532 1 852 . 1 1 108 108 PHE C C 13 176.894 0.2 . 1 . . . A 108 PHE C . 17532 1 853 . 1 1 108 108 PHE CA C 13 61.300 0.2 . 1 . . . A 108 PHE CA . 17532 1 854 . 1 1 108 108 PHE CB C 13 39.520 0.2 . 1 . . . A 108 PHE CB . 17532 1 855 . 1 1 108 108 PHE N N 15 118.738 0.2 . 1 . . . A 108 PHE N . 17532 1 856 . 1 1 109 109 ARG H H 1 7.748 0.04 . 1 . . . A 109 ARG H . 17532 1 857 . 1 1 109 109 ARG HA H 1 3.984 0.04 . 1 . . . A 109 ARG HA . 17532 1 858 . 1 1 109 109 ARG HB2 H 1 2.010 0.04 . 2 . . . A 109 ARG HB2 . 17532 1 859 . 1 1 109 109 ARG C C 13 178.317 0.2 . 1 . . . A 109 ARG C . 17532 1 860 . 1 1 109 109 ARG CA C 13 58.870 0.2 . 1 . . . A 109 ARG CA . 17532 1 861 . 1 1 109 109 ARG CB C 13 30.081 0.2 . 1 . . . A 109 ARG CB . 17532 1 862 . 1 1 109 109 ARG N N 15 115.762 0.2 . 1 . . . A 109 ARG N . 17532 1 863 . 1 1 110 110 GLU H H 1 7.437 0.04 . 1 . . . A 110 GLU H . 17532 1 864 . 1 1 110 110 GLU HA H 1 3.964 0.04 . 1 . . . A 110 GLU HA . 17532 1 865 . 1 1 110 110 GLU HB2 H 1 2.038 0.04 . 2 . . . A 110 GLU HB2 . 17532 1 866 . 1 1 110 110 GLU C C 13 178.128 0.2 . 1 . . . A 110 GLU C . 17532 1 867 . 1 1 110 110 GLU CA C 13 58.373 0.2 . 1 . . . A 110 GLU CA . 17532 1 868 . 1 1 110 110 GLU CB C 13 29.297 0.2 . 1 . . . A 110 GLU CB . 17532 1 869 . 1 1 110 110 GLU N N 15 117.304 0.2 . 1 . . . A 110 GLU N . 17532 1 870 . 1 1 111 111 PHE H H 1 7.577 0.04 . 1 . . . A 111 PHE H . 17532 1 871 . 1 1 111 111 PHE HA H 1 4.518 0.04 . 1 . . . A 111 PHE HA . 17532 1 872 . 1 1 111 111 PHE HB2 H 1 2.817 0.04 . 2 . . . A 111 PHE HB2 . 17532 1 873 . 1 1 111 111 PHE C C 13 176.554 0.2 . 1 . . . A 111 PHE C . 17532 1 874 . 1 1 111 111 PHE CA C 13 58.031 0.2 . 1 . . . A 111 PHE CA . 17532 1 875 . 1 1 111 111 PHE CB C 13 39.258 0.2 . 1 . . . A 111 PHE CB . 17532 1 876 . 1 1 111 111 PHE N N 15 116.764 0.2 . 1 . . . A 111 PHE N . 17532 1 877 . 1 1 112 112 ASP H H 1 7.519 0.04 . 1 . . . A 112 ASP H . 17532 1 878 . 1 1 112 112 ASP HA H 1 4.565 0.04 . 1 . . . A 112 ASP HA . 17532 1 879 . 1 1 112 112 ASP HB2 H 1 1.805 0.04 . 2 . . . A 112 ASP HB2 . 17532 1 880 . 1 1 112 112 ASP HB3 H 1 2.655 0.04 . 2 . . . A 112 ASP HB3 . 17532 1 881 . 1 1 112 112 ASP C C 13 176.980 0.2 . 1 . . . A 112 ASP C . 17532 1 882 . 1 1 112 112 ASP CA C 13 52.316 0.2 . 1 . . . A 112 ASP CA . 17532 1 883 . 1 1 112 112 ASP CB C 13 39.066 0.2 . 1 . . . A 112 ASP CB . 17532 1 884 . 1 1 112 112 ASP N N 15 118.644 0.2 . 1 . . . A 112 ASP N . 17532 1 885 . 1 1 113 113 THR H H 1 7.909 0.04 . 1 . . . A 113 THR H . 17532 1 886 . 1 1 113 113 THR HA H 1 4.016 0.04 . 1 . . . A 113 THR HA . 17532 1 887 . 1 1 113 113 THR HB H 1 4.246 0.04 . 1 . . . A 113 THR HB . 17532 1 888 . 1 1 113 113 THR HG21 H 1 1.321 0.04 . 1 . . . A 113 THR HG21 . 17532 1 889 . 1 1 113 113 THR HG22 H 1 1.321 0.04 . 1 . . . A 113 THR HG22 . 17532 1 890 . 1 1 113 113 THR HG23 H 1 1.321 0.04 . 1 . . . A 113 THR HG23 . 17532 1 891 . 1 1 113 113 THR C C 13 176.393 0.2 . 1 . . . A 113 THR C . 17532 1 892 . 1 1 113 113 THR CA C 13 65.145 0.2 . 1 . . . A 113 THR CA . 17532 1 893 . 1 1 113 113 THR CB C 13 68.837 0.2 . 1 . . . A 113 THR CB . 17532 1 894 . 1 1 113 113 THR CG2 C 13 22.560 0.2 . 1 . . . A 113 THR CG2 . 17532 1 895 . 1 1 113 113 THR N N 15 118.287 0.2 . 1 . . . A 113 THR N . 17532 1 896 . 1 1 114 114 ASN H H 1 8.077 0.04 . 1 . . . A 114 ASN H . 17532 1 897 . 1 1 114 114 ASN HA H 1 4.873 0.04 . 1 . . . A 114 ASN HA . 17532 1 898 . 1 1 114 114 ASN HB2 H 1 3.336 0.04 . 2 . . . A 114 ASN HB2 . 17532 1 899 . 1 1 114 114 ASN HB3 H 1 2.916 0.04 . 2 . . . A 114 ASN HB3 . 17532 1 900 . 1 1 114 114 ASN C C 13 176.650 0.2 . 1 . . . A 114 ASN C . 17532 1 901 . 1 1 114 114 ASN CA C 13 51.994 0.2 . 1 . . . A 114 ASN CA . 17532 1 902 . 1 1 114 114 ASN CB C 13 37.379 0.2 . 1 . . . A 114 ASN CB . 17532 1 903 . 1 1 114 114 ASN N N 15 115.932 0.2 . 1 . . . A 114 ASN N . 17532 1 904 . 1 1 115 115 GLY H H 1 7.699 0.04 . 1 . . . A 115 GLY H . 17532 1 905 . 1 1 115 115 GLY HA2 H 1 3.865 0.04 . 2 . . . A 115 GLY HA2 . 17532 1 906 . 1 1 115 115 GLY HA3 H 1 3.865 0.04 . 2 . . . A 115 GLY HA3 . 17532 1 907 . 1 1 115 115 GLY C C 13 174.800 0.2 . 1 . . . A 115 GLY C . 17532 1 908 . 1 1 115 115 GLY CA C 13 47.476 0.2 . 1 . . . A 115 GLY CA . 17532 1 909 . 1 1 115 115 GLY N N 15 109.332 0.2 . 1 . . . A 115 GLY N . 17532 1 910 . 1 1 116 116 ASP H H 1 8.023 0.04 . 1 . . . A 116 ASP H . 17532 1 911 . 1 1 116 116 ASP HA H 1 4.571 0.04 . 1 . . . A 116 ASP HA . 17532 1 912 . 1 1 116 116 ASP HB2 H 1 2.471 0.04 . 2 . . . A 116 ASP HB2 . 17532 1 913 . 1 1 116 116 ASP HB3 H 1 3.164 0.04 . 2 . . . A 116 ASP HB3 . 17532 1 914 . 1 1 116 116 ASP C C 13 177.569 0.2 . 1 . . . A 116 ASP C . 17532 1 915 . 1 1 116 116 ASP CA C 13 53.370 0.2 . 1 . . . A 116 ASP CA . 17532 1 916 . 1 1 116 116 ASP CB C 13 40.430 0.2 . 1 . . . A 116 ASP CB . 17532 1 917 . 1 1 116 116 ASP N N 15 118.900 0.2 . 1 . . . A 116 ASP N . 17532 1 918 . 1 1 117 117 GLY H H 1 10.370 0.04 . 1 . . . A 117 GLY H . 17532 1 919 . 1 1 117 117 GLY HA2 H 1 4.327 0.04 . 2 . . . A 117 GLY HA2 . 17532 1 920 . 1 1 117 117 GLY HA3 H 1 3.648 0.04 . 2 . . . A 117 GLY HA3 . 17532 1 921 . 1 1 117 117 GLY C C 13 173.200 0.2 . 1 . . . A 117 GLY C . 17532 1 922 . 1 1 117 117 GLY CA C 13 45.638 0.2 . 1 . . . A 117 GLY CA . 17532 1 923 . 1 1 117 117 GLY N N 15 112.570 0.2 . 1 . . . A 117 GLY N . 17532 1 924 . 1 1 118 118 GLU H H 1 7.912 0.04 . 1 . . . A 118 GLU H . 17532 1 925 . 1 1 118 118 GLU HA H 1 4.920 0.04 . 1 . . . A 118 GLU HA . 17532 1 926 . 1 1 118 118 GLU HB2 H 1 1.792 0.04 . 2 . . . A 118 GLU HB2 . 17532 1 927 . 1 1 118 118 GLU HB3 H 1 1.873 0.04 . 2 . . . A 118 GLU HB3 . 17532 1 928 . 1 1 118 118 GLU C C 13 174.368 0.2 . 1 . . . A 118 GLU C . 17532 1 929 . 1 1 118 118 GLU CA C 13 54.009 0.2 . 1 . . . A 118 GLU CA . 17532 1 930 . 1 1 118 118 GLU CB C 13 33.717 0.2 . 1 . . . A 118 GLU CB . 17532 1 931 . 1 1 118 118 GLU N N 15 117.446 0.2 . 1 . . . A 118 GLU N . 17532 1 932 . 1 1 119 119 ILE H H 1 9.396 0.04 . 1 . . . A 119 ILE H . 17532 1 933 . 1 1 119 119 ILE HA H 1 4.955 0.04 . 1 . . . A 119 ILE HA . 17532 1 934 . 1 1 119 119 ILE HB H 1 2.060 0.04 . 1 . . . A 119 ILE HB . 17532 1 935 . 1 1 119 119 ILE HG12 H 1 0.933 0.04 . 2 . . . A 119 ILE HG12 . 17532 1 936 . 1 1 119 119 ILE HG13 H 1 0.439 0.04 . 2 . . . A 119 ILE HG13 . 17532 1 937 . 1 1 119 119 ILE HG21 H 1 0.932 0.04 . 1 . . . A 119 ILE HG21 . 17532 1 938 . 1 1 119 119 ILE HG22 H 1 0.932 0.04 . 1 . . . A 119 ILE HG22 . 17532 1 939 . 1 1 119 119 ILE HG23 H 1 0.932 0.04 . 1 . . . A 119 ILE HG23 . 17532 1 940 . 1 1 119 119 ILE HD11 H 1 0.311 0.04 . 1 . . . A 119 ILE HD11 . 17532 1 941 . 1 1 119 119 ILE HD12 H 1 0.311 0.04 . 1 . . . A 119 ILE HD12 . 17532 1 942 . 1 1 119 119 ILE HD13 H 1 0.311 0.04 . 1 . . . A 119 ILE HD13 . 17532 1 943 . 1 1 119 119 ILE C C 13 175.569 0.2 . 1 . . . A 119 ILE C . 17532 1 944 . 1 1 119 119 ILE CA C 13 59.779 0.2 . 1 . . . A 119 ILE CA . 17532 1 945 . 1 1 119 119 ILE CB C 13 37.986 0.2 . 1 . . . A 119 ILE CB . 17532 1 946 . 1 1 119 119 ILE CG2 C 13 18.660 0.2 . 1 . . . A 119 ILE CG2 . 17532 1 947 . 1 1 119 119 ILE CD1 C 13 14.520 0.2 . 1 . . . A 119 ILE CD1 . 17532 1 948 . 1 1 119 119 ILE N N 15 126.916 0.2 . 1 . . . A 119 ILE N . 17532 1 949 . 1 1 120 120 SER H H 1 9.274 0.04 . 1 . . . A 120 SER H . 17532 1 950 . 1 1 120 120 SER HA H 1 4.880 0.04 . 1 . . . A 120 SER HA . 17532 1 951 . 1 1 120 120 SER HB2 H 1 4.499 0.04 . 2 . . . A 120 SER HB2 . 17532 1 952 . 1 1 120 120 SER HB3 H 1 4.063 0.04 . 2 . . . A 120 SER HB3 . 17532 1 953 . 1 1 120 120 SER C C 13 175.616 0.2 . 1 . . . A 120 SER C . 17532 1 954 . 1 1 120 120 SER CA C 13 56.953 0.2 . 1 . . . A 120 SER CA . 17532 1 955 . 1 1 120 120 SER CB C 13 65.788 0.2 . 1 . . . A 120 SER CB . 17532 1 956 . 1 1 120 120 SER N N 15 124.347 0.2 . 1 . . . A 120 SER N . 17532 1 957 . 1 1 121 121 THR H H 1 8.793 0.04 . 1 . . . A 121 THR H . 17532 1 958 . 1 1 121 121 THR HA H 1 3.843 0.04 . 1 . . . A 121 THR HA . 17532 1 959 . 1 1 121 121 THR HB H 1 4.229 0.04 . 1 . . . A 121 THR HB . 17532 1 960 . 1 1 121 121 THR HG21 H 1 1.267 0.04 . 1 . . . A 121 THR HG21 . 17532 1 961 . 1 1 121 121 THR HG22 H 1 1.267 0.04 . 1 . . . A 121 THR HG22 . 17532 1 962 . 1 1 121 121 THR HG23 H 1 1.267 0.04 . 1 . . . A 121 THR HG23 . 17532 1 963 . 1 1 121 121 THR CA C 13 66.940 0.2 . 1 . . . A 121 THR CA . 17532 1 964 . 1 1 121 121 THR CB C 13 67.965 0.2 . 1 . . . A 121 THR CB . 17532 1 965 . 1 1 121 121 THR CG2 C 13 22.850 0.2 . 1 . . . A 121 THR CG2 . 17532 1 966 . 1 1 121 121 THR N N 15 114.110 0.2 . 1 . . . A 121 THR N . 17532 1 967 . 1 1 122 122 SER HA H 1 4.242 0.04 . 1 . . . A 122 SER HA . 17532 1 968 . 1 1 122 122 SER HB2 H 1 3.936 0.04 . 2 . . . A 122 SER HB2 . 17532 1 969 . 1 1 122 122 SER HB3 H 1 3.936 0.04 . 2 . . . A 122 SER HB3 . 17532 1 970 . 1 1 122 122 SER C C 13 177.216 0.2 . 1 . . . A 122 SER C . 17532 1 971 . 1 1 122 122 SER CA C 13 62.340 0.2 . 1 . . . A 122 SER CA . 17532 1 972 . 1 1 122 122 SER CB C 13 62.340 0.2 . 1 . . . A 122 SER CB . 17532 1 973 . 1 1 123 123 GLU H H 1 7.752 0.04 . 1 . . . A 123 GLU H . 17532 1 974 . 1 1 123 123 GLU HA H 1 4.231 0.04 . 1 . . . A 123 GLU HA . 17532 1 975 . 1 1 123 123 GLU HB2 H 1 2.445 0.04 . 2 . . . A 123 GLU HB2 . 17532 1 976 . 1 1 123 123 GLU HB3 H 1 2.344 0.04 . 2 . . . A 123 GLU HB3 . 17532 1 977 . 1 1 123 123 GLU C C 13 180.458 0.2 . 1 . . . A 123 GLU C . 17532 1 978 . 1 1 123 123 GLU CA C 13 58.708 0.2 . 1 . . . A 123 GLU CA . 17532 1 979 . 1 1 123 123 GLU CB C 13 29.512 0.2 . 1 . . . A 123 GLU CB . 17532 1 980 . 1 1 123 123 GLU N N 15 123.363 0.2 . 1 . . . A 123 GLU N . 17532 1 981 . 1 1 124 124 LEU H H 1 8.815 0.04 . 1 . . . A 124 LEU H . 17532 1 982 . 1 1 124 124 LEU HA H 1 3.988 0.04 . 1 . . . A 124 LEU HA . 17532 1 983 . 1 1 124 124 LEU HB2 H 1 2.006 0.04 . 2 . . . A 124 LEU HB2 . 17532 1 984 . 1 1 124 124 LEU HB3 H 1 1.526 0.04 . 2 . . . A 124 LEU HB3 . 17532 1 985 . 1 1 124 124 LEU HG H 1 1.658 0.04 . 1 . . . A 124 LEU HG . 17532 1 986 . 1 1 124 124 LEU HD11 H 1 0.981 0.04 . 1 . . . A 124 LEU HD11 . 17532 1 987 . 1 1 124 124 LEU HD12 H 1 0.981 0.04 . 1 . . . A 124 LEU HD12 . 17532 1 988 . 1 1 124 124 LEU HD13 H 1 0.981 0.04 . 1 . . . A 124 LEU HD13 . 17532 1 989 . 1 1 124 124 LEU HD21 H 1 0.968 0.04 . 1 . . . A 124 LEU HD21 . 17532 1 990 . 1 1 124 124 LEU HD22 H 1 0.968 0.04 . 1 . . . A 124 LEU HD22 . 17532 1 991 . 1 1 124 124 LEU HD23 H 1 0.968 0.04 . 1 . . . A 124 LEU HD23 . 17532 1 992 . 1 1 124 124 LEU C C 13 177.807 0.2 . 1 . . . A 124 LEU C . 17532 1 993 . 1 1 124 124 LEU CA C 13 57.972 0.2 . 1 . . . A 124 LEU CA . 17532 1 994 . 1 1 124 124 LEU CB C 13 41.353 0.2 . 1 . . . A 124 LEU CB . 17532 1 995 . 1 1 124 124 LEU CD1 C 13 23.280 0.2 . 1 . . . A 124 LEU CD1 . 17532 1 996 . 1 1 124 124 LEU CD2 C 13 26.620 0.2 . 1 . . . A 124 LEU CD2 . 17532 1 997 . 1 1 124 124 LEU N N 15 122.468 0.2 . 1 . . . A 124 LEU N . 17532 1 998 . 1 1 125 125 ARG H H 1 8.340 0.04 . 1 . . . A 125 ARG H . 17532 1 999 . 1 1 125 125 ARG HA H 1 3.696 0.04 . 1 . . . A 125 ARG HA . 17532 1 1000 . 1 1 125 125 ARG HB2 H 1 2.061 0.04 . 2 . . . A 125 ARG HB2 . 17532 1 1001 . 1 1 125 125 ARG HB3 H 1 1.949 0.04 . 2 . . . A 125 ARG HB3 . 17532 1 1002 . 1 1 125 125 ARG C C 13 178.343 0.2 . 1 . . . A 125 ARG C . 17532 1 1003 . 1 1 125 125 ARG CA C 13 60.485 0.2 . 1 . . . A 125 ARG CA . 17532 1 1004 . 1 1 125 125 ARG CB C 13 30.323 0.2 . 1 . . . A 125 ARG CB . 17532 1 1005 . 1 1 125 125 ARG N N 15 119.165 0.2 . 1 . . . A 125 ARG N . 17532 1 1006 . 1 1 126 126 GLU H H 1 7.675 0.04 . 1 . . . A 126 GLU H . 17532 1 1007 . 1 1 126 126 GLU HA H 1 4.179 0.04 . 1 . . . A 126 GLU HA . 17532 1 1008 . 1 1 126 126 GLU HB2 H 1 1.726 0.04 . 2 . . . A 126 GLU HB2 . 17532 1 1009 . 1 1 126 126 GLU HB3 H 1 1.635 0.04 . 2 . . . A 126 GLU HB3 . 17532 1 1010 . 1 1 126 126 GLU C C 13 178.776 0.2 . 1 . . . A 126 GLU C . 17532 1 1011 . 1 1 126 126 GLU CA C 13 58.707 0.2 . 1 . . . A 126 GLU CA . 17532 1 1012 . 1 1 126 126 GLU CB C 13 29.607 0.2 . 1 . . . A 126 GLU CB . 17532 1 1013 . 1 1 126 126 GLU N N 15 117.125 0.2 . 1 . . . A 126 GLU N . 17532 1 1014 . 1 1 127 127 ALA H H 1 7.900 0.04 . 1 . . . A 127 ALA H . 17532 1 1015 . 1 1 127 127 ALA HA H 1 3.870 0.04 . 1 . . . A 127 ALA HA . 17532 1 1016 . 1 1 127 127 ALA HB1 H 1 0.797 0.04 . 1 . . . A 127 ALA HB1 . 17532 1 1017 . 1 1 127 127 ALA HB2 H 1 0.797 0.04 . 1 . . . A 127 ALA HB2 . 17532 1 1018 . 1 1 127 127 ALA HB3 H 1 0.797 0.04 . 1 . . . A 127 ALA HB3 . 17532 1 1019 . 1 1 127 127 ALA C C 13 180.006 0.2 . 1 . . . A 127 ALA C . 17532 1 1020 . 1 1 127 127 ALA CA C 13 54.967 0.2 . 1 . . . A 127 ALA CA . 17532 1 1021 . 1 1 127 127 ALA CB C 13 17.785 0.2 . 1 . . . A 127 ALA CB . 17532 1 1022 . 1 1 127 127 ALA N N 15 121.671 0.2 . 1 . . . A 127 ALA N . 17532 1 1023 . 1 1 128 128 MET H H 1 8.353 0.04 . 1 . . . A 128 MET H . 17532 1 1024 . 1 1 128 128 MET HA H 1 4.211 0.04 . 1 . . . A 128 MET HA . 17532 1 1025 . 1 1 128 128 MET HB2 H 1 2.122 0.04 . 2 . . . A 128 MET HB2 . 17532 1 1026 . 1 1 128 128 MET C C 13 178.160 0.2 . 1 . . . A 128 MET C . 17532 1 1027 . 1 1 128 128 MET CA C 13 57.670 0.2 . 1 . . . A 128 MET CA . 17532 1 1028 . 1 1 128 128 MET CB C 13 31.930 0.2 . 1 . . . A 128 MET CB . 17532 1 1029 . 1 1 128 128 MET N N 15 115.083 0.2 . 1 . . . A 128 MET N . 17532 1 1030 . 1 1 129 129 ARG H H 1 7.904 0.04 . 1 . . . A 129 ARG H . 17532 1 1031 . 1 1 129 129 ARG HA H 1 3.747 0.04 . 1 . . . A 129 ARG HA . 17532 1 1032 . 1 1 129 129 ARG HB2 H 1 2.060 0.04 . 2 . . . A 129 ARG HB2 . 17532 1 1033 . 1 1 129 129 ARG CA C 13 59.320 0.2 . 1 . . . A 129 ARG CA . 17532 1 1034 . 1 1 129 129 ARG CB C 13 29.812 0.2 . 1 . . . A 129 ARG CB . 17532 1 1035 . 1 1 129 129 ARG N N 15 119.493 0.2 . 1 . . . A 129 ARG N . 17532 1 1036 . 1 1 130 130 LYS HA H 1 4.073 0.04 . 1 . . . A 130 LYS HA . 17532 1 1037 . 1 1 130 130 LYS HB2 H 1 1.962 0.04 . 2 . . . A 130 LYS HB2 . 17532 1 1038 . 1 1 130 130 LYS C C 13 178.421 0.2 . 1 . . . A 130 LYS C . 17532 1 1039 . 1 1 130 130 LYS CA C 13 59.130 0.2 . 1 . . . A 130 LYS CA . 17532 1 1040 . 1 1 130 130 LYS CB C 13 32.670 0.2 . 1 . . . A 130 LYS CB . 17532 1 1041 . 1 1 131 131 LEU H H 1 8.059 0.04 . 1 . . . A 131 LEU H . 17532 1 1042 . 1 1 131 131 LEU HA H 1 4.246 0.04 . 1 . . . A 131 LEU HA . 17532 1 1043 . 1 1 131 131 LEU HB2 H 1 1.798 0.04 . 2 . . . A 131 LEU HB2 . 17532 1 1044 . 1 1 131 131 LEU HB3 H 1 1.543 0.04 . 2 . . . A 131 LEU HB3 . 17532 1 1045 . 1 1 131 131 LEU HD11 H 1 0.897 0.04 . 1 . . . A 131 LEU HD11 . 17532 1 1046 . 1 1 131 131 LEU HD12 H 1 0.897 0.04 . 1 . . . A 131 LEU HD12 . 17532 1 1047 . 1 1 131 131 LEU HD13 H 1 0.897 0.04 . 1 . . . A 131 LEU HD13 . 17532 1 1048 . 1 1 131 131 LEU HD21 H 1 0.965 0.04 . 1 . . . A 131 LEU HD21 . 17532 1 1049 . 1 1 131 131 LEU HD22 H 1 0.965 0.04 . 1 . . . A 131 LEU HD22 . 17532 1 1050 . 1 1 131 131 LEU HD23 H 1 0.965 0.04 . 1 . . . A 131 LEU HD23 . 17532 1 1051 . 1 1 131 131 LEU C C 13 178.363 0.2 . 1 . . . A 131 LEU C . 17532 1 1052 . 1 1 131 131 LEU CA C 13 57.177 0.2 . 1 . . . A 131 LEU CA . 17532 1 1053 . 1 1 131 131 LEU CB C 13 43.352 0.2 . 1 . . . A 131 LEU CB . 17532 1 1054 . 1 1 131 131 LEU CD1 C 13 25.090 0.2 . 1 . . . A 131 LEU CD1 . 17532 1 1055 . 1 1 131 131 LEU CD2 C 13 23.730 0.2 . 1 . . . A 131 LEU CD2 . 17532 1 1056 . 1 1 131 131 LEU N N 15 118.200 0.2 . 1 . . . A 131 LEU N . 17532 1 1057 . 1 1 132 132 LEU H H 1 8.292 0.04 . 1 . . . A 132 LEU H . 17532 1 1058 . 1 1 132 132 LEU HA H 1 4.416 0.04 . 1 . . . A 132 LEU HA . 17532 1 1059 . 1 1 132 132 LEU HB2 H 1 1.744 0.04 . 2 . . . A 132 LEU HB2 . 17532 1 1060 . 1 1 132 132 LEU HB3 H 1 1.401 0.04 . 2 . . . A 132 LEU HB3 . 17532 1 1061 . 1 1 132 132 LEU HD11 H 1 0.811 0.04 . 1 . . . A 132 LEU HD11 . 17532 1 1062 . 1 1 132 132 LEU HD12 H 1 0.811 0.04 . 1 . . . A 132 LEU HD12 . 17532 1 1063 . 1 1 132 132 LEU HD13 H 1 0.811 0.04 . 1 . . . A 132 LEU HD13 . 17532 1 1064 . 1 1 132 132 LEU C C 13 178.404 0.2 . 1 . . . A 132 LEU C . 17532 1 1065 . 1 1 132 132 LEU CA C 13 55.369 0.2 . 1 . . . A 132 LEU CA . 17532 1 1066 . 1 1 132 132 LEU CB C 13 42.900 0.2 . 1 . . . A 132 LEU CB . 17532 1 1067 . 1 1 132 132 LEU CD1 C 13 25.81 0.2 . 1 . . . A 132 LEU CD1 . 17532 1 1068 . 1 1 132 132 LEU N N 15 115.873 0.2 . 1 . . . A 132 LEU N . 17532 1 1069 . 1 1 133 133 GLY H H 1 7.672 0.04 . 1 . . . A 133 GLY H . 17532 1 1070 . 1 1 133 133 GLY HA2 H 1 4.162 0.04 . 2 . . . A 133 GLY HA2 . 17532 1 1071 . 1 1 133 133 GLY HA3 H 1 3.875 0.04 . 2 . . . A 133 GLY HA3 . 17532 1 1072 . 1 1 133 133 GLY CA C 13 46.107 0.2 . 1 . . . A 133 GLY CA . 17532 1 1073 . 1 1 133 133 GLY N N 15 107.097 0.2 . 1 . . . A 133 GLY N . 17532 1 1074 . 1 1 135 135 GLN HA H 1 4.326 0.04 . 1 . . . A 135 GLN HA . 17532 1 1075 . 1 1 135 135 GLN HB2 H 1 2.096 0.04 . 2 . . . A 135 GLN HB2 . 17532 1 1076 . 1 1 135 135 GLN HB3 H 1 1.982 0.04 . 2 . . . A 135 GLN HB3 . 17532 1 1077 . 1 1 135 135 GLN C C 13 175.917 0.2 . 1 . . . A 135 GLN C . 17532 1 1078 . 1 1 135 135 GLN CA C 13 56.390 0.2 . 1 . . . A 135 GLN CA . 17532 1 1079 . 1 1 135 135 GLN CB C 13 29.390 0.2 . 1 . . . A 135 GLN CB . 17532 1 1080 . 1 1 136 136 VAL H H 1 7.878 0.04 . 1 . . . A 136 VAL H . 17532 1 1081 . 1 1 136 136 VAL HA H 1 4.250 0.04 . 1 . . . A 136 VAL HA . 17532 1 1082 . 1 1 136 136 VAL HB H 1 2.089 0.04 . 1 . . . A 136 VAL HB . 17532 1 1083 . 1 1 136 136 VAL HG11 H 1 0.967 0.04 . 1 . . . A 136 VAL HG11 . 17532 1 1084 . 1 1 136 136 VAL HG12 H 1 0.967 0.04 . 1 . . . A 136 VAL HG12 . 17532 1 1085 . 1 1 136 136 VAL HG13 H 1 0.967 0.04 . 1 . . . A 136 VAL HG13 . 17532 1 1086 . 1 1 136 136 VAL HG21 H 1 0.926 0.04 . 1 . . . A 136 VAL HG21 . 17532 1 1087 . 1 1 136 136 VAL HG22 H 1 0.926 0.04 . 1 . . . A 136 VAL HG22 . 17532 1 1088 . 1 1 136 136 VAL HG23 H 1 0.926 0.04 . 1 . . . A 136 VAL HG23 . 17532 1 1089 . 1 1 136 136 VAL C C 13 175.832 0.2 . 1 . . . A 136 VAL C . 17532 1 1090 . 1 1 136 136 VAL CA C 13 61.833 0.2 . 1 . . . A 136 VAL CA . 17532 1 1091 . 1 1 136 136 VAL CB C 13 33.037 0.2 . 1 . . . A 136 VAL CB . 17532 1 1092 . 1 1 136 136 VAL CG1 C 13 21.780 0.2 . 1 . . . A 136 VAL CG1 . 17532 1 1093 . 1 1 136 136 VAL CG2 C 13 20.990 0.2 . 1 . . . A 136 VAL CG2 . 17532 1 1094 . 1 1 136 136 VAL N N 15 119.530 0.2 . 1 . . . A 136 VAL N . 17532 1 1095 . 1 1 137 137 GLY H H 1 8.736 0.04 . 1 . . . A 137 GLY H . 17532 1 1096 . 1 1 137 137 GLY HA2 H 1 4.043 0.04 . 2 . . . A 137 GLY HA2 . 17532 1 1097 . 1 1 137 137 GLY HA3 H 1 4.043 0.04 . 2 . . . A 137 GLY HA3 . 17532 1 1098 . 1 1 137 137 GLY CA C 13 45.086 0.2 . 1 . . . A 137 GLY CA . 17532 1 1099 . 1 1 137 137 GLY N N 15 112.040 0.2 . 1 . . . A 137 GLY N . 17532 1 1100 . 1 1 141 141 ILE HA H 1 3.765 0.04 . 1 . . . A 141 ILE HA . 17532 1 1101 . 1 1 141 141 ILE HB H 1 2.058 0.04 . 1 . . . A 141 ILE HB . 17532 1 1102 . 1 1 141 141 ILE HG12 H 1 1.505 0.04 . 2 . . . A 141 ILE HG12 . 17532 1 1103 . 1 1 141 141 ILE HG13 H 1 1.318 0.04 . 2 . . . A 141 ILE HG13 . 17532 1 1104 . 1 1 141 141 ILE HG21 H 1 0.962 0.04 . 1 . . . A 141 ILE HG21 . 17532 1 1105 . 1 1 141 141 ILE HG22 H 1 0.962 0.04 . 1 . . . A 141 ILE HG22 . 17532 1 1106 . 1 1 141 141 ILE HG23 H 1 0.962 0.04 . 1 . . . A 141 ILE HG23 . 17532 1 1107 . 1 1 141 141 ILE HD11 H 1 0.782 0.04 . 1 . . . A 141 ILE HD11 . 17532 1 1108 . 1 1 141 141 ILE HD12 H 1 0.782 0.04 . 1 . . . A 141 ILE HD12 . 17532 1 1109 . 1 1 141 141 ILE HD13 H 1 0.782 0.04 . 1 . . . A 141 ILE HD13 . 17532 1 1110 . 1 1 141 141 ILE C C 13 176.974 0.2 . 1 . . . A 141 ILE C . 17532 1 1111 . 1 1 141 141 ILE CA C 13 63.180 0.2 . 1 . . . A 141 ILE CA . 17532 1 1112 . 1 1 141 141 ILE CB C 13 36.740 0.2 . 1 . . . A 141 ILE CB . 17532 1 1113 . 1 1 141 141 ILE CG2 C 13 18.240 0.2 . 1 . . . A 141 ILE CG2 . 17532 1 1114 . 1 1 141 141 ILE CD1 C 13 12.410 0.2 . 1 . . . A 141 ILE CD1 . 17532 1 1115 . 1 1 142 142 GLU H H 1 8.067 0.04 . 1 . . . A 142 GLU H . 17532 1 1116 . 1 1 142 142 GLU HA H 1 3.955 0.04 . 1 . . . A 142 GLU HA . 17532 1 1117 . 1 1 142 142 GLU HB2 H 1 2.104 0.04 . 2 . . . A 142 GLU HB2 . 17532 1 1118 . 1 1 142 142 GLU C C 13 179.211 0.2 . 1 . . . A 142 GLU C . 17532 1 1119 . 1 1 142 142 GLU CA C 13 59.384 0.2 . 1 . . . A 142 GLU CA . 17532 1 1120 . 1 1 142 142 GLU CB C 13 29.116 0.2 . 1 . . . A 142 GLU CB . 17532 1 1121 . 1 1 142 142 GLU N N 15 118.989 0.2 . 1 . . . A 142 GLU N . 17532 1 1122 . 1 1 143 143 GLU H H 1 7.633 0.04 . 1 . . . A 143 GLU H . 17532 1 1123 . 1 1 143 143 GLU HA H 1 4.045 0.04 . 1 . . . A 143 GLU HA . 17532 1 1124 . 1 1 143 143 GLU HB2 H 1 2.157 0.04 . 2 . . . A 143 GLU HB2 . 17532 1 1125 . 1 1 143 143 GLU C C 13 178.455 0.2 . 1 . . . A 143 GLU C . 17532 1 1126 . 1 1 143 143 GLU CA C 13 59.228 0.2 . 1 . . . A 143 GLU CA . 17532 1 1127 . 1 1 143 143 GLU CB C 13 29.628 0.2 . 1 . . . A 143 GLU CB . 17532 1 1128 . 1 1 143 143 GLU N N 15 117.954 0.2 . 1 . . . A 143 GLU N . 17532 1 1129 . 1 1 144 144 ILE H H 1 7.598 0.04 . 1 . . . A 144 ILE H . 17532 1 1130 . 1 1 144 144 ILE HA H 1 3.805 0.04 . 1 . . . A 144 ILE HA . 17532 1 1131 . 1 1 144 144 ILE HB H 1 1.972 0.04 . 1 . . . A 144 ILE HB . 17532 1 1132 . 1 1 144 144 ILE HG12 H 1 1.819 0.04 . 2 . . . A 144 ILE HG12 . 17532 1 1133 . 1 1 144 144 ILE HG13 H 1 1.086 0.04 . 2 . . . A 144 ILE HG13 . 17532 1 1134 . 1 1 144 144 ILE HG21 H 1 0.902 0.04 . 1 . . . A 144 ILE HG21 . 17532 1 1135 . 1 1 144 144 ILE HG22 H 1 0.902 0.04 . 1 . . . A 144 ILE HG22 . 17532 1 1136 . 1 1 144 144 ILE HG23 H 1 0.902 0.04 . 1 . . . A 144 ILE HG23 . 17532 1 1137 . 1 1 144 144 ILE HD11 H 1 0.802 0.04 . 1 . . . A 144 ILE HD11 . 17532 1 1138 . 1 1 144 144 ILE HD12 H 1 0.802 0.04 . 1 . . . A 144 ILE HD12 . 17532 1 1139 . 1 1 144 144 ILE HD13 H 1 0.802 0.04 . 1 . . . A 144 ILE HD13 . 17532 1 1140 . 1 1 144 144 ILE C C 13 178.092 0.2 . 1 . . . A 144 ILE C . 17532 1 1141 . 1 1 144 144 ILE CA C 13 64.947 0.2 . 1 . . . A 144 ILE CA . 17532 1 1142 . 1 1 144 144 ILE CB C 13 38.457 0.2 . 1 . . . A 144 ILE CB . 17532 1 1143 . 1 1 144 144 ILE CG1 C 13 28.910 0.2 . 1 . . . A 144 ILE CG1 . 17532 1 1144 . 1 1 144 144 ILE CG2 C 13 17.440 0.2 . 1 . . . A 144 ILE CG2 . 17532 1 1145 . 1 1 144 144 ILE CD1 C 13 13.700 0.2 . 1 . . . A 144 ILE CD1 . 17532 1 1146 . 1 1 144 144 ILE N N 15 119.581 0.2 . 1 . . . A 144 ILE N . 17532 1 1147 . 1 1 145 145 ILE H H 1 8.035 0.04 . 1 . . . A 145 ILE H . 17532 1 1148 . 1 1 145 145 ILE HA H 1 3.700 0.04 . 1 . . . A 145 ILE HA . 17532 1 1149 . 1 1 145 145 ILE HB H 1 1.995 0.04 . 1 . . . A 145 ILE HB . 17532 1 1150 . 1 1 145 145 ILE HG12 H 1 1.575 0.04 . 2 . . . A 145 ILE HG12 . 17532 1 1151 . 1 1 145 145 ILE HG13 H 1 1.210 0.04 . 2 . . . A 145 ILE HG13 . 17532 1 1152 . 1 1 145 145 ILE HG21 H 1 0.905 0.04 . 1 . . . A 145 ILE HG21 . 17532 1 1153 . 1 1 145 145 ILE HG22 H 1 0.905 0.04 . 1 . . . A 145 ILE HG22 . 17532 1 1154 . 1 1 145 145 ILE HG23 H 1 0.905 0.04 . 1 . . . A 145 ILE HG23 . 17532 1 1155 . 1 1 145 145 ILE HD11 H 1 0.744 0.04 . 1 . . . A 145 ILE HD11 . 17532 1 1156 . 1 1 145 145 ILE HD12 H 1 0.744 0.04 . 1 . . . A 145 ILE HD12 . 17532 1 1157 . 1 1 145 145 ILE HD13 H 1 0.744 0.04 . 1 . . . A 145 ILE HD13 . 17532 1 1158 . 1 1 145 145 ILE C C 13 177.184 0.2 . 1 . . . A 145 ILE C . 17532 1 1159 . 1 1 145 145 ILE CA C 13 64.377 0.2 . 1 . . . A 145 ILE CA . 17532 1 1160 . 1 1 145 145 ILE CB C 13 37.478 0.2 . 1 . . . A 145 ILE CB . 17532 1 1161 . 1 1 145 145 ILE CG2 C 13 17.370 0.2 . 1 . . . A 145 ILE CG2 . 17532 1 1162 . 1 1 145 145 ILE CD1 C 13 13.060 0.2 . 1 . . . A 145 ILE CD1 . 17532 1 1163 . 1 1 145 145 ILE N N 15 116.702 0.2 . 1 . . . A 145 ILE N . 17532 1 1164 . 1 1 146 146 ARG H H 1 7.554 0.04 . 1 . . . A 146 ARG H . 17532 1 1165 . 1 1 146 146 ARG HA H 1 4.091 0.04 . 1 . . . A 146 ARG HA . 17532 1 1166 . 1 1 146 146 ARG C C 13 177.768 0.2 . 1 . . . A 146 ARG C . 17532 1 1167 . 1 1 146 146 ARG CA C 13 59.241 0.2 . 1 . . . A 146 ARG CA . 17532 1 1168 . 1 1 146 146 ARG CB C 13 30.132 0.2 . 1 . . . A 146 ARG CB . 17532 1 1169 . 1 1 146 146 ARG N N 15 118.923 0.2 . 1 . . . A 146 ARG N . 17532 1 1170 . 1 1 147 147 ASP H H 1 7.653 0.04 . 1 . . . A 147 ASP H . 17532 1 1171 . 1 1 147 147 ASP HA H 1 4.580 0.04 . 1 . . . A 147 ASP HA . 17532 1 1172 . 1 1 147 147 ASP HB2 H 1 2.782 0.04 . 2 . . . A 147 ASP HB2 . 17532 1 1173 . 1 1 147 147 ASP C C 13 177.272 0.2 . 1 . . . A 147 ASP C . 17532 1 1174 . 1 1 147 147 ASP CA C 13 55.858 0.2 . 1 . . . A 147 ASP CA . 17532 1 1175 . 1 1 147 147 ASP CB C 13 41.799 0.2 . 1 . . . A 147 ASP CB . 17532 1 1176 . 1 1 147 147 ASP N N 15 116.963 0.2 . 1 . . . A 147 ASP N . 17532 1 1177 . 1 1 148 148 VAL H H 1 7.725 0.04 . 1 . . . A 148 VAL H . 17532 1 1178 . 1 1 148 148 VAL HA H 1 4.134 0.04 . 1 . . . A 148 VAL HA . 17532 1 1179 . 1 1 148 148 VAL HB H 1 2.182 0.04 . 1 . . . A 148 VAL HB . 17532 1 1180 . 1 1 148 148 VAL HG11 H 1 1.002 0.04 . 1 . . . A 148 VAL HG11 . 17532 1 1181 . 1 1 148 148 VAL HG12 H 1 1.002 0.04 . 1 . . . A 148 VAL HG12 . 17532 1 1182 . 1 1 148 148 VAL HG13 H 1 1.002 0.04 . 1 . . . A 148 VAL HG13 . 17532 1 1183 . 1 1 148 148 VAL C C 13 176.607 0.2 . 1 . . . A 148 VAL C . 17532 1 1184 . 1 1 148 148 VAL CA C 13 63.064 0.2 . 1 . . . A 148 VAL CA . 17532 1 1185 . 1 1 148 148 VAL CB C 13 32.842 0.2 . 1 . . . A 148 VAL CB . 17532 1 1186 . 1 1 148 148 VAL CG1 C 13 21.760 0.2 . 1 . . . A 148 VAL CG1 . 17532 1 1187 . 1 1 148 148 VAL N N 15 113.980 0.2 . 1 . . . A 148 VAL N . 17532 1 1188 . 1 1 149 149 ASP H H 1 7.964 0.04 . 1 . . . A 149 ASP H . 17532 1 1189 . 1 1 149 149 ASP HA H 1 4.737 0.04 . 1 . . . A 149 ASP HA . 17532 1 1190 . 1 1 149 149 ASP HB2 H 1 2.271 0.04 . 2 . . . A 149 ASP HB2 . 17532 1 1191 . 1 1 149 149 ASP HB3 H 1 2.979 0.04 . 2 . . . A 149 ASP HB3 . 17532 1 1192 . 1 1 149 149 ASP C C 13 176.889 0.2 . 1 . . . A 149 ASP C . 17532 1 1193 . 1 1 149 149 ASP CA C 13 52.729 0.2 . 1 . . . A 149 ASP CA . 17532 1 1194 . 1 1 149 149 ASP CB C 13 39.201 0.2 . 1 . . . A 149 ASP CB . 17532 1 1195 . 1 1 149 149 ASP N N 15 119.370 0.2 . 1 . . . A 149 ASP N . 17532 1 1196 . 1 1 150 150 LEU H H 1 7.857 0.04 . 1 . . . A 150 LEU H . 17532 1 1197 . 1 1 150 150 LEU HA H 1 4.127 0.04 . 1 . . . A 150 LEU HA . 17532 1 1198 . 1 1 150 150 LEU HB2 H 1 1.882 0.04 . 2 . . . A 150 LEU HB2 . 17532 1 1199 . 1 1 150 150 LEU HB3 H 1 1.664 0.04 . 2 . . . A 150 LEU HB3 . 17532 1 1200 . 1 1 150 150 LEU HD11 H 1 1.013 0.04 . 1 . . . A 150 LEU HD11 . 17532 1 1201 . 1 1 150 150 LEU HD12 H 1 1.013 0.04 . 1 . . . A 150 LEU HD12 . 17532 1 1202 . 1 1 150 150 LEU HD13 H 1 1.013 0.04 . 1 . . . A 150 LEU HD13 . 17532 1 1203 . 1 1 150 150 LEU HD21 H 1 0.909 0.04 . 1 . . . A 150 LEU HD21 . 17532 1 1204 . 1 1 150 150 LEU HD22 H 1 0.909 0.04 . 1 . . . A 150 LEU HD22 . 17532 1 1205 . 1 1 150 150 LEU HD23 H 1 0.909 0.04 . 1 . . . A 150 LEU HD23 . 17532 1 1206 . 1 1 150 150 LEU C C 13 178.431 0.2 . 1 . . . A 150 LEU C . 17532 1 1207 . 1 1 150 150 LEU CA C 13 57.443 0.2 . 1 . . . A 150 LEU CA . 17532 1 1208 . 1 1 150 150 LEU CB C 13 42.547 0.2 . 1 . . . A 150 LEU CB . 17532 1 1209 . 1 1 150 150 LEU CD1 C 13 25.350 0.2 . 1 . . . A 150 LEU CD1 . 17532 1 1210 . 1 1 150 150 LEU CD2 C 13 22.760 0.2 . 1 . . . A 150 LEU CD2 . 17532 1 1211 . 1 1 150 150 LEU N N 15 126.597 0.2 . 1 . . . A 150 LEU N . 17532 1 1212 . 1 1 151 151 ASN H H 1 8.015 0.04 . 1 . . . A 151 ASN H . 17532 1 1213 . 1 1 151 151 ASN HA H 1 4.856 0.04 . 1 . . . A 151 ASN HA . 17532 1 1214 . 1 1 151 151 ASN HB2 H 1 3.347 0.04 . 2 . . . A 151 ASN HB2 . 17532 1 1215 . 1 1 151 151 ASN HB3 H 1 2.928 0.04 . 2 . . . A 151 ASN HB3 . 17532 1 1216 . 1 1 151 151 ASN C C 13 176.665 0.2 . 1 . . . A 151 ASN C . 17532 1 1217 . 1 1 151 151 ASN CA C 13 51.684 0.2 . 1 . . . A 151 ASN CA . 17532 1 1218 . 1 1 151 151 ASN CB C 13 37.338 0.2 . 1 . . . A 151 ASN CB . 17532 1 1219 . 1 1 151 151 ASN N N 15 112.525 0.2 . 1 . . . A 151 ASN N . 17532 1 1220 . 1 1 152 152 GLY H H 1 7.623 0.04 . 1 . . . A 152 GLY H . 17532 1 1221 . 1 1 152 152 GLY HA2 H 1 3.865 0.04 . 2 . . . A 152 GLY HA2 . 17532 1 1222 . 1 1 152 152 GLY HA3 H 1 3.865 0.04 . 2 . . . A 152 GLY HA3 . 17532 1 1223 . 1 1 152 152 GLY C C 13 174.818 0.2 . 1 . . . A 152 GLY C . 17532 1 1224 . 1 1 152 152 GLY CA C 13 47.652 0.2 . 1 . . . A 152 GLY CA . 17532 1 1225 . 1 1 152 152 GLY N N 15 108.895 0.2 . 1 . . . A 152 GLY N . 17532 1 1226 . 1 1 153 153 ASP H H 1 8.025 0.04 . 1 . . . A 153 ASP H . 17532 1 1227 . 1 1 153 153 ASP HA H 1 4.569 0.04 . 1 . . . A 153 ASP HA . 17532 1 1228 . 1 1 153 153 ASP HB2 H 1 2.471 0.04 . 2 . . . A 153 ASP HB2 . 17532 1 1229 . 1 1 153 153 ASP HB3 H 1 3.138 0.04 . 2 . . . A 153 ASP HB3 . 17532 1 1230 . 1 1 153 153 ASP C C 13 177.770 0.2 . 1 . . . A 153 ASP C . 17532 1 1231 . 1 1 153 153 ASP CA C 13 53.422 0.2 . 1 . . . A 153 ASP CA . 17532 1 1232 . 1 1 153 153 ASP CB C 13 40.612 0.2 . 1 . . . A 153 ASP CB . 17532 1 1233 . 1 1 153 153 ASP N N 15 118.899 0.2 . 1 . . . A 153 ASP N . 17532 1 1234 . 1 1 154 154 GLY H H 1 10.378 0.04 . 1 . . . A 154 GLY H . 17532 1 1235 . 1 1 154 154 GLY HA2 H 1 4.170 0.04 . 2 . . . A 154 GLY HA2 . 17532 1 1236 . 1 1 154 154 GLY HA3 H 1 3.539 0.04 . 2 . . . A 154 GLY HA3 . 17532 1 1237 . 1 1 154 154 GLY C C 13 173.426 0.2 . 1 . . . A 154 GLY C . 17532 1 1238 . 1 1 154 154 GLY CA C 13 45.831 0.2 . 1 . . . A 154 GLY CA . 17532 1 1239 . 1 1 154 154 GLY N N 15 112.922 0.2 . 1 . . . A 154 GLY N . 17532 1 1240 . 1 1 155 155 ARG H H 1 8.050 0.04 . 1 . . . A 155 ARG H . 17532 1 1241 . 1 1 155 155 ARG HA H 1 4.915 0.04 . 1 . . . A 155 ARG HA . 17532 1 1242 . 1 1 155 155 ARG HB2 H 1 1.623 0.04 . 2 . . . A 155 ARG HB2 . 17532 1 1243 . 1 1 155 155 ARG C C 13 174.500 0.2 . 1 . . . A 155 ARG C . 17532 1 1244 . 1 1 155 155 ARG CA C 13 53.847 0.2 . 1 . . . A 155 ARG CA . 17532 1 1245 . 1 1 155 155 ARG CB C 13 33.020 0.2 . 1 . . . A 155 ARG CB . 17532 1 1246 . 1 1 155 155 ARG N N 15 118.172 0.2 . 1 . . . A 155 ARG N . 17532 1 1247 . 1 1 156 156 VAL H H 1 9.407 0.04 . 1 . . . A 156 VAL H . 17532 1 1248 . 1 1 156 156 VAL HA H 1 5.107 0.04 . 1 . . . A 156 VAL HA . 17532 1 1249 . 1 1 156 156 VAL HB H 1 2.268 0.04 . 1 . . . A 156 VAL HB . 17532 1 1250 . 1 1 156 156 VAL HG11 H 1 1.202 0.04 . 1 . . . A 156 VAL HG11 . 17532 1 1251 . 1 1 156 156 VAL HG12 H 1 1.202 0.04 . 1 . . . A 156 VAL HG12 . 17532 1 1252 . 1 1 156 156 VAL HG13 H 1 1.202 0.04 . 1 . . . A 156 VAL HG13 . 17532 1 1253 . 1 1 156 156 VAL HG21 H 1 0.850 0.04 . 1 . . . A 156 VAL HG21 . 17532 1 1254 . 1 1 156 156 VAL HG22 H 1 0.850 0.04 . 1 . . . A 156 VAL HG22 . 17532 1 1255 . 1 1 156 156 VAL HG23 H 1 0.850 0.04 . 1 . . . A 156 VAL HG23 . 17532 1 1256 . 1 1 156 156 VAL C C 13 175.615 0.2 . 1 . . . A 156 VAL C . 17532 1 1257 . 1 1 156 156 VAL CA C 13 61.303 0.2 . 1 . . . A 156 VAL CA . 17532 1 1258 . 1 1 156 156 VAL CB C 13 32.915 0.2 . 1 . . . A 156 VAL CB . 17532 1 1259 . 1 1 156 156 VAL CG1 C 13 21.550 0.2 . 1 . . . A 156 VAL CG1 . 17532 1 1260 . 1 1 156 156 VAL CG2 C 13 21.730 0.2 . 1 . . . A 156 VAL CG2 . 17532 1 1261 . 1 1 156 156 VAL N N 15 126.397 0.2 . 1 . . . A 156 VAL N . 17532 1 1262 . 1 1 157 157 ASP H H 1 8.805 0.04 . 1 . . . A 157 ASP H . 17532 1 1263 . 1 1 157 157 ASP HA H 1 5.174 0.04 . 1 . . . A 157 ASP HA . 17532 1 1264 . 1 1 157 157 ASP HB2 H 1 2.797 0.04 . 2 . . . A 157 ASP HB2 . 17532 1 1265 . 1 1 157 157 ASP HB3 H 1 3.320 0.04 . 2 . . . A 157 ASP HB3 . 17532 1 1266 . 1 1 157 157 ASP C C 13 176.218 0.2 . 1 . . . A 157 ASP C . 17532 1 1267 . 1 1 157 157 ASP CA C 13 52.653 0.2 . 1 . . . A 157 ASP CA . 17532 1 1268 . 1 1 157 157 ASP CB C 13 41.905 0.2 . 1 . . . A 157 ASP CB . 17532 1 1269 . 1 1 157 157 ASP N N 15 127.907 0.2 . 1 . . . A 157 ASP N . 17532 1 1270 . 1 1 158 158 PHE H H 1 8.836 0.04 . 1 . . . A 158 PHE H . 17532 1 1271 . 1 1 158 158 PHE HA H 1 3.730 0.04 . 1 . . . A 158 PHE HA . 17532 1 1272 . 1 1 158 158 PHE HB2 H 1 2.718 0.04 . 2 . . . A 158 PHE HB2 . 17532 1 1273 . 1 1 158 158 PHE HB3 H 1 2.501 0.04 . 2 . . . A 158 PHE HB3 . 17532 1 1274 . 1 1 158 158 PHE HD1 H 1 6.679 0.04 . 3 . . . A 158 PHE HD1 . 17532 1 1275 . 1 1 158 158 PHE HD2 H 1 6.679 0.04 . 3 . . . A 158 PHE HD2 . 17532 1 1276 . 1 1 158 158 PHE HE1 H 1 7.086 0.04 . 3 . . . A 158 PHE HE1 . 17532 1 1277 . 1 1 158 158 PHE HE2 H 1 7.086 0.04 . 3 . . . A 158 PHE HE2 . 17532 1 1278 . 1 1 158 158 PHE HZ H 1 7.115 0.04 . 1 . . . A 158 PHE HZ . 17532 1 1279 . 1 1 158 158 PHE C C 13 176.547 0.2 . 1 . . . A 158 PHE C . 17532 1 1280 . 1 1 158 158 PHE CA C 13 62.579 0.2 . 1 . . . A 158 PHE CA . 17532 1 1281 . 1 1 158 158 PHE CB C 13 38.636 0.2 . 1 . . . A 158 PHE CB . 17532 1 1282 . 1 1 158 158 PHE N N 15 118.693 0.2 . 1 . . . A 158 PHE N . 17532 1 1283 . 1 1 159 159 GLU H H 1 8.159 0.04 . 1 . . . A 159 GLU H . 17532 1 1284 . 1 1 159 159 GLU HA H 1 3.760 0.04 . 1 . . . A 159 GLU HA . 17532 1 1285 . 1 1 159 159 GLU HB2 H 1 2.184 0.04 . 2 . . . A 159 GLU HB2 . 17532 1 1286 . 1 1 159 159 GLU C C 13 180.429 0.2 . 1 . . . A 159 GLU C . 17532 1 1287 . 1 1 159 159 GLU CA C 13 60.258 0.2 . 1 . . . A 159 GLU CA . 17532 1 1288 . 1 1 159 159 GLU CB C 13 28.882 0.2 . 1 . . . A 159 GLU CB . 17532 1 1289 . 1 1 159 159 GLU N N 15 117.881 0.2 . 1 . . . A 159 GLU N . 17532 1 1290 . 1 1 160 160 GLU H H 1 8.583 0.04 . 1 . . . A 160 GLU H . 17532 1 1291 . 1 1 160 160 GLU HA H 1 4.042 0.04 . 1 . . . A 160 GLU HA . 17532 1 1292 . 1 1 160 160 GLU C C 13 179.544 0.2 . 1 . . . A 160 GLU C . 17532 1 1293 . 1 1 160 160 GLU CA C 13 58.867 0.2 . 1 . . . A 160 GLU CA . 17532 1 1294 . 1 1 160 160 GLU CB C 13 29.685 0.2 . 1 . . . A 160 GLU CB . 17532 1 1295 . 1 1 160 160 GLU N N 15 120.813 0.2 . 1 . . . A 160 GLU N . 17532 1 1296 . 1 1 161 161 PHE H H 1 8.835 0.04 . 1 . . . A 161 PHE H . 17532 1 1297 . 1 1 161 161 PHE HA H 1 4.035 0.04 . 1 . . . A 161 PHE HA . 17532 1 1298 . 1 1 161 161 PHE HB2 H 1 3.124 0.04 . 2 . . . A 161 PHE HB2 . 17532 1 1299 . 1 1 161 161 PHE HD1 H 1 6.936 0.04 . 3 . . . A 161 PHE HD1 . 17532 1 1300 . 1 1 161 161 PHE HD2 H 1 6.936 0.04 . 3 . . . A 161 PHE HD2 . 17532 1 1301 . 1 1 161 161 PHE HE1 H 1 7.159 0.04 . 3 . . . A 161 PHE HE1 . 17532 1 1302 . 1 1 161 161 PHE HE2 H 1 7.159 0.04 . 3 . . . A 161 PHE HE2 . 17532 1 1303 . 1 1 161 161 PHE HZ H 1 7.050 0.04 . 1 . . . A 161 PHE HZ . 17532 1 1304 . 1 1 161 161 PHE C C 13 176.432 0.2 . 1 . . . A 161 PHE C . 17532 1 1305 . 1 1 161 161 PHE CA C 13 61.384 0.2 . 1 . . . A 161 PHE CA . 17532 1 1306 . 1 1 161 161 PHE CB C 13 39.650 0.2 . 1 . . . A 161 PHE CB . 17532 1 1307 . 1 1 161 161 PHE N N 15 123.389 0.2 . 1 . . . A 161 PHE N . 17532 1 1308 . 1 1 162 162 VAL H H 1 8.474 0.04 . 1 . . . A 162 VAL H . 17532 1 1309 . 1 1 162 162 VAL HA H 1 3.034 0.04 . 1 . . . A 162 VAL HA . 17532 1 1310 . 1 1 162 162 VAL HB H 1 3.033 0.04 . 1 . . . A 162 VAL HB . 17532 1 1311 . 1 1 162 162 VAL HG11 H 1 0.690 0.04 . 1 . . . A 162 VAL HG11 . 17532 1 1312 . 1 1 162 162 VAL HG12 H 1 0.690 0.04 . 1 . . . A 162 VAL HG12 . 17532 1 1313 . 1 1 162 162 VAL HG13 H 1 0.690 0.04 . 1 . . . A 162 VAL HG13 . 17532 1 1314 . 1 1 162 162 VAL HG21 H 1 0.385 0.04 . 1 . . . A 162 VAL HG21 . 17532 1 1315 . 1 1 162 162 VAL HG22 H 1 0.385 0.04 . 1 . . . A 162 VAL HG22 . 17532 1 1316 . 1 1 162 162 VAL HG23 H 1 0.385 0.04 . 1 . . . A 162 VAL HG23 . 17532 1 1317 . 1 1 162 162 VAL C C 13 179.125 0.2 . 1 . . . A 162 VAL C . 17532 1 1318 . 1 1 162 162 VAL CA C 13 66.924 0.2 . 1 . . . A 162 VAL CA . 17532 1 1319 . 1 1 162 162 VAL CB C 13 31.415 0.2 . 1 . . . A 162 VAL CB . 17532 1 1320 . 1 1 162 162 VAL CG1 C 13 21.340 0.2 . 1 . . . A 162 VAL CG1 . 17532 1 1321 . 1 1 162 162 VAL CG2 C 13 23.400 0.2 . 1 . . . A 162 VAL CG2 . 17532 1 1322 . 1 1 162 162 VAL N N 15 119.378 0.2 . 1 . . . A 162 VAL N . 17532 1 1323 . 1 1 163 163 ARG H H 1 7.513 0.04 . 1 . . . A 163 ARG H . 17532 1 1324 . 1 1 163 163 ARG HA H 1 3.974 0.04 . 1 . . . A 163 ARG HA . 17532 1 1325 . 1 1 163 163 ARG HB2 H 1 1.864 0.04 . 2 . . . A 163 ARG HB2 . 17532 1 1326 . 1 1 163 163 ARG C C 13 178.602 0.2 . 1 . . . A 163 ARG C . 17532 1 1327 . 1 1 163 163 ARG CA C 13 59.250 0.2 . 1 . . . A 163 ARG CA . 17532 1 1328 . 1 1 163 163 ARG CB C 13 29.451 0.2 . 1 . . . A 163 ARG CB . 17532 1 1329 . 1 1 163 163 ARG N N 15 119.505 0.2 . 1 . . . A 163 ARG N . 17532 1 1330 . 1 1 164 164 MET H H 1 7.735 0.04 . 1 . . . A 164 MET H . 17532 1 1331 . 1 1 164 164 MET HA H 1 4.015 0.04 . 1 . . . A 164 MET HA . 17532 1 1332 . 1 1 164 164 MET C C 13 177.036 0.2 . 1 . . . A 164 MET C . 17532 1 1333 . 1 1 164 164 MET CA C 13 58.674 0.2 . 1 . . . A 164 MET CA . 17532 1 1334 . 1 1 164 164 MET CB C 13 32.734 0.2 . 1 . . . A 164 MET CB . 17532 1 1335 . 1 1 164 164 MET N N 15 119.076 0.2 . 1 . . . A 164 MET N . 17532 1 1336 . 1 1 165 165 MET H H 1 7.482 0.04 . 1 . . . A 165 MET H . 17532 1 1337 . 1 1 165 165 MET HA H 1 4.418 0.04 . 1 . . . A 165 MET HA . 17532 1 1338 . 1 1 165 165 MET C C 13 176.607 0.2 . 1 . . . A 165 MET C . 17532 1 1339 . 1 1 165 165 MET CA C 13 54.799 0.2 . 1 . . . A 165 MET CA . 17532 1 1340 . 1 1 165 165 MET CB C 13 32.119 0.2 . 1 . . . A 165 MET CB . 17532 1 1341 . 1 1 165 165 MET N N 15 114.128 0.2 . 1 . . . A 165 MET N . 17532 1 1342 . 1 1 166 166 SER H H 1 7.530 0.04 . 1 . . . A 166 SER H . 17532 1 1343 . 1 1 166 166 SER HA H 1 4.590 0.04 . 1 . . . A 166 SER HA . 17532 1 1344 . 1 1 166 166 SER HB2 H 1 3.889 0.04 . 2 . . . A 166 SER HB2 . 17532 1 1345 . 1 1 166 166 SER C C 13 173.167 0.2 . 1 . . . A 166 SER C . 17532 1 1346 . 1 1 166 166 SER CA C 13 58.521 0.2 . 1 . . . A 166 SER CA . 17532 1 1347 . 1 1 166 166 SER CB C 13 64.174 0.2 . 1 . . . A 166 SER CB . 17532 1 1348 . 1 1 166 166 SER N N 15 114.238 0.2 . 1 . . . A 166 SER N . 17532 1 1349 . 1 1 167 167 ARG H H 1 7.462 0.04 . 1 . . . A 167 ARG H . 17532 1 1350 . 1 1 167 167 ARG HA H 1 4.181 0.04 . 1 . . . A 167 ARG HA . 17532 1 1351 . 1 1 167 167 ARG HB2 H 1 1.783 0.04 . 2 . . . A 167 ARG HB2 . 17532 1 1352 . 1 1 167 167 ARG CA C 13 57.959 0.2 . 1 . . . A 167 ARG CA . 17532 1 1353 . 1 1 167 167 ARG CB C 13 31.435 0.2 . 1 . . . A 167 ARG CB . 17532 1 1354 . 1 1 167 167 ARG N N 15 127.118 0.2 . 1 . . . A 167 ARG N . 17532 1 stop_ save_